Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L4B8WI
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| Ligand Name |
1-methyl-4-[(5~{S})-3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperazine
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| Synonyms |
CHEMBL428892; 1-methyl-4-[(5~{S})-3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperazine; 101395-29-3; (+)-Metitepine; 89F; Methiothepin; Metitepine; BDBM50154716; ZINC19362650; EN300-27692885; (-)-1-Methyl-4-(8-methylsulfanyl-10,11-dihydro-dibenzo[b,f]thiepin-10-yl)-piperazine; 1-Methyl-4-((S)-8-methylsulfanyl-10,11-dihydro-dibenzo[b,f]thiepin-10-yl)-piperazine; 1-methyl-4-[(9S)-6-(methylsulfanyl)-2-thiatricyclo[9.4.0.0,3,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-9-yl]piperazine
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| Structure |
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Download2D MOL |
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| Formula |
C20H24N2S2
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| Canonical SMILES |
CN1CCN(CC1)C2CC3=CC=CC=C3SC4=C2C=C(C=C4)SC
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| InChI |
1S/C20H24N2S2/c1-21-9-11-22(12-10-21)18-13-15-5-3-4-6-19(15)24-20-8-7-16(23-2)14-17(18)20/h3-8,14,18H,9-13H2,1-2H3/t18-/m0/s1
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| InChIKey |
RLJFTICUTYVZDG-SFHVURJKSA-N
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| PubChem Compound ID | ||||
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