5-chloranyl-N-[(2S,3R)-4-(4-methylpiperazin-1-yl)-3-oxidanyl-4-oxidanylidene-1-phenyl-butan-2-yl]-1H-indole-2-carboxamide hydrochloride

Systemtic Name: 5-chloranyl-N-[(2S,3R)-4-(4-methylpiperazin-1-yl)-3-oxidanyl-4-oxidanylidene-1-phenyl-butan-2-yl]-1H-indole-2-carboxamide hydrochloride Openeye Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-(4-methylpiperazin-1-yl)-3-oxo-propyl]-5-chloro-1H-indole-2-carboxamide hydrochloride CAS Name: 5-chloro-N-[(2S,3R)-3-hydroxy-4-(4-methyl-1-piperazinyl)-4-oxo-1-phenylbutan-2-yl]-1H-indole-2-carboxamide hydrochloride IUPAC Name: 5-chloro-N-[(2S,3R)-3-hydroxy-4-(4-methylpiperazin-1-yl)-4-oxo-1-phenylbutan-2-yl]-1H-indole-2-carboxamide hydrochloride Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-keto-3-(4-methylpiperazino)propyl]-5-chloro-1H-indole-2-carboxamide hydrochloride Formula: C24H28Cl2N4O3 MolecularWeight: 491.41012

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C(C(CC2=CC=CC=C2)NC(=O)C3=CC4=C(N3)C=CC(=C4)Cl)O.Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)[C@@H]([C@H](CC2=CC=CC=C2)NC(=O)C3=CC4=C(N3)C=CC(=C4)Cl)O.Cl

InChI

InChI=1S/C24H27ClN4O3.ClH/c1-28-9-11-29(12-10-28)24(32)22(30)20(13-16-5-3-2-4-6-16)27-23(31)21-15-17-14-18(25)7-8-19(17)26-21;/h2-8,14-15,20,22,26,30H,9-13H2,1H3,(H,27,31);1H/t20-,22+;/m0./s1