Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L5UTS0
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| Ligand Name |
7-chloro-N-[(1S,2R,4S)-4-(dimethylcarbamoyl)-2-{[(5-methyl-5,6-dihydro-4H-pyrrolo[3,4-d][1,3]thiazol-2-yl)carbonyl]amino}cyclohexyl]isoquinoline-3-carboxamide
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| Synonyms |
7-chloro-N-[(1S,2R,4S)-4-(dimethylcarbamoyl)-2-{[(5-methyl-5,6-dihydro-4H-pyrrolo[3,4-d][1,3]thiazol-2-yl)carbonyl]amino}cyclohexyl]isoquinoline-3-carboxamide; CHEMBL593603; SCHEMBL12036298; BDBM35772; cis-1,2-diaminocyclohexane derivative, 45c; Q27459031
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| Structure |
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Download2D MOL |
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| Formula |
C26H29ClN6O3S
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| Canonical SMILES |
CN1CC2=C(C1)SC(=N2)C(=O)NC3CC(CCC3NC(=O)C4=NC=C5C=C(C=CC5=C4)Cl)C(=O)N(C)C
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| InChI |
1S/C26H29ClN6O3S/c1-32(2)26(36)15-5-7-18(29-23(34)20-9-14-4-6-17(27)8-16(14)11-28-20)19(10-15)30-24(35)25-31-21-12-33(3)13-22(21)37-25/h4,6,8-9,11,15,18-19H,5,7,10,12-13H2,1-3H3,(H,29,34)(H,30,35)/t15-,18-,19+/m0/s1
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| InChIKey |
GZCKMZURFJCTJE-ZYSHUDEJSA-N
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| PubChem Compound ID | ||||
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