HIT ID: HIT212667662
Cas No: 2357114-70-4
分子式: C34H40N4O6S
分子量: 632.78
常用名: cIAP1 ligand 2
氢键受体数 (HBA): 6
氢键供体数 (HBD): 2
LogP: 5.2847657
IUPAC: benzyl N-[(1S)-1-{[(1S)-1-cyclohexyl-2-[(2S)-2-[4-(3-hydroxybenzoyl)-1,3-thiazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]carbamoyl}ethyl]-N-methylcarbamate
IUPAC: benzyl N-[(1S)-1-{[(1S)-1-cyclohexyl-2-[(2S)-2-[4-(3-hydroxybenzoyl)-1,3-thiazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]carbamoyl}ethyl]-N-methylcarbamate
SMILES: C[C@H](N(C)C(=O)OCc1ccccc1)C(=O)N[C@@H](C1CCCCC1)C(=O)N1CCC[C@H]1c1nc(cs1)C(=O)c1cccc(O)c1
SMILES: C[C@H](N(C)C(=O)OCc1ccccc1)C(=O)N[C@@H](C1CCCCC1)C(=O)N1CCC[C@H]1c1nc(cs1)C(=O)c1cccc(O)c1
InChI key: WAZFEKJBUJBBQP-ZRKWFTTGSA-N
