(2S)-4-(1-methylpyrrol-2-yl)carbonyl-N-[(3S)-2-oxidanylidenepiperidin-3-yl]-1-(phenylcarbonyl)piperazine-2-carboxamide

Systemtic Name: (2S)-4-(1-methylpyrrol-2-yl)carbonyl-N-[(3S)-2-oxidanylidenepiperidin-3-yl]-1-(phenylcarbonyl)piperazine-2-carboxamide Openeye Name: (2S)-1-benzoyl-4-(1-methylpyrrole-2-carbonyl)-N-[(3S)-2-oxo-3-piperidyl]piperazine-2-carboxamide CAS Name: (2S)-1-benzoyl-4-[(1-methyl-2-pyrrolyl)-oxomethyl]-N-[(3S)-2-oxo-3-piperidinyl]-2-piperazinecarboxamide IUPAC Name: (2S)-1-benzoyl-4-(1-methylpyrrole-2-carbonyl)-N-[(3S)-2-oxopiperidin-3-yl]piperazine-2-carboxamide Traditional Name: (2S)-1-benzoyl-N-[(3S)-2-keto-3-piperidyl]-4-(1-methylpyrrole-2-carbonyl)piperazine-2-carboxamide Formula: C23H27N5O4 MolecularWeight: 437.49158

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)N2CCN(C(C2)C(=O)NC3CCCNC3=O)C(=O)C4=CC=CC=C4

Isomeric SMILES

CN1C=CC=C1C(=O)N2CCN([C@@H](C2)C(=O)N[C@H]3CCCNC3=O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H27N5O4/c1-26-12-6-10-18(26)23(32)27-13-14-28(22(31)16-7-3-2-4-8-16)19(15-27)21(30)25-17-9-5-11-24-20(17)29/h2-4,6-8,10,12,17,19H,5,9,11,13-15H2,1H3,(H,24,29)(H,25,30)/t17-,19-/m0/s1