(3S)-N1-(4-ethanoylphenyl)-N3-[(3S)-2-oxidanylidenepiperidin-3-yl]-4-pyrazin-2-ylcarbonyl-piperazine-1,3-dicarboxamide

Systemtic Name: (3S)-N1-(4-ethanoylphenyl)-N3-[(3S)-2-oxidanylidenepiperidin-3-yl]-4-pyrazin-2-ylcarbonyl-piperazine-1,3-dicarboxamide Openeye Name: (3S)-N1-(4-acetylphenyl)-N3-[(3S)-2-oxo-3-piperidyl]-4-(pyrazine-2-carbonyl)piperazine-1,3-dicarboxamide CAS Name: (3S)-N1-(4-acetylphenyl)-N3-[(3S)-2-oxo-3-piperidinyl]-4-[oxo(2-pyrazinyl)methyl]piperazine-1,3-dicarboxamide IUPAC Name: (3S)-1-N-(4-acetylphenyl)-3-N-[(3S)-2-oxopiperidin-3-yl]-4-(pyrazine-2-carbonyl)piperazine-1,3-dicarboxamide Traditional Name: (3S)-N-(4-acetylphenyl)-N'-[(3S)-2-keto-3-piperidyl]-4-pyrazinoyl-piperazine-1,3-dicarboxamide Formula: C24H27N7O5 MolecularWeight: 493.51508

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(C(C2)C(=O)NC3CCCNC3=O)C(=O)C4=NC=CN=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)N2CCN([C@@H](C2)C(=O)N[C@H]3CCCNC3=O)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C24H27N7O5/c1-15(32)16-4-6-17(7-5-16)28-24(36)30-11-12-31(23(35)19-13-25-9-10-26-19)20(14-30)22(34)29-18-3-2-8-27-21(18)33/h4-7,9-10,13,18,20H,2-3,8,11-12,14H2,1H3,(H,27,33)(H,28,36)(H,29,34)/t18-,20-/m0/s1