(1R)-N-[(1S)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl]-2-[4-(1H-indazol-3-ylcarbonyl)piperazin-1-yl]cyclohexane-1-carboxamide

Systemtic Name: (1R)-N-[(1S)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl]-2-[4-(1H-indazol-3-ylcarbonyl)piperazin-1-yl]cyclohexane-1-carboxamide Openeye Name: (1R)-N-[(1S)-2-amino-2-oxo-1-phenyl-ethyl]-2-[4-(1H-indazole-3-carbonyl)piperazin-1-yl]cyclohexanecarboxamide CAS Name: (1R)-N-[(1S)-2-amino-2-oxo-1-phenylethyl]-2-[4-[1H-indazol-3-yl(oxo)methyl]-1-piperazinyl]-1-cyclohexanecarboxamide IUPAC Name: (1R)-N-[(1S)-2-amino-2-oxo-1-phenylethyl]-2-[4-(1H-indazole-3-carbonyl)piperazin-1-yl]cyclohexane-1-carboxamide Traditional Name: (1R)-N-[(1S)-2-amino-2-keto-1-phenyl-ethyl]-2-[4-(1H-indazole-3-carbonyl)piperazino]cyclohexanecarboxamide Formula: C27H32N6O3 MolecularWeight: 488.58138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC(C2=CC=CC=C2)C(=O)N)N3CCN(CC3)C(=O)C4=NNC5=CC=CC=C54

Isomeric SMILES

C1CCC([C@@H](C1)C(=O)N[C@@H](C2=CC=CC=C2)C(=O)N)N3CCN(CC3)C(=O)C4=NNC5=CC=CC=C54

InChI

InChI=1S/C27H32N6O3/c28-25(34)23(18-8-2-1-3-9-18)29-26(35)20-11-5-7-13-22(20)32-14-16-33(17-15-32)27(36)24-19-10-4-6-12-21(19)30-31-24/h1-4,6,8-10,12,20,22-23H,5,7,11,13-17H2,(H2,28,34)(H,29,35)(H,30,31)/t20-,22?,23+/m1/s1