4-(1H-indol-3-ylcarbonyl)-N-[(2S)-1-[(3-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxamide

Systemtic Name: 4-(1H-indol-3-ylcarbonyl)-N-[(2S)-1-[(3-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxamide Openeye Name: 4-(1H-indole-3-carbonyl)-N-[(1S)-2-[(3-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl]piperazine-1-carboxamide CAS Name: 4-[1H-indol-3-yl(oxo)methyl]-N-[(2S)-1-[(3-methoxyphenyl)methylamino]-1-oxopropan-2-yl]-1-piperazinecarboxamide IUPAC Name: 4-(1H-indole-3-carbonyl)-N-[(2S)-1-[(3-methoxyphenyl)methylamino]-1-oxopropan-2-yl]piperazine-1-carboxamide Traditional Name: 4-(1H-indole-3-carbonyl)-N-[(1S)-2-keto-2-(m-anisylamino)-1-methyl-ethyl]piperazine-1-carboxamide Formula: C25H29N5O4 MolecularWeight: 463.52886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=CC=C1)OC)NC(=O)N2CCN(CC2)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC(=CC=C1)OC)NC(=O)N2CCN(CC2)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C25H29N5O4/c1-17(23(31)27-15-18-6-5-7-19(14-18)34-2)28-25(33)30-12-10-29(11-13-30)24(32)21-16-26-22-9-4-3-8-20(21)22/h3-9,14,16-17,26H,10-13,15H2,1-2H3,(H,27,31)(H,28,33)/t17-/m0/s1