5-methyl-N-(2-methylpropyl)-N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]pyrazine-2-carboxamide

Systemtic Name: 5-methyl-N-(2-methylpropyl)-N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]pyrazine-2-carboxamide Openeye Name: N-isobutyl-5-methyl-N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxo-propyl]pyrazine-2-carboxamide CAS Name: 5-methyl-N-(2-methylpropyl)-N-[3-[4-(4-nitrophenyl)-1-piperazinyl]-3-oxopropyl]-2-pyrazinecarboxamide IUPAC Name: 5-methyl-N-(2-methylpropyl)-N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropyl]pyrazine-2-carboxamide Traditional Name: N-isobutyl-N-[3-keto-3-[4-(4-nitrophenyl)piperazino]propyl]-5-methyl-pyrazinamide Formula: C23H30N6O4 MolecularWeight: 454.5221

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N(CCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])CC(C)C

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N(CCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])CC(C)C

InChI

InChI=1S/C23H30N6O4/c1-17(2)16-28(23(31)21-15-24-18(3)14-25-21)9-8-22(30)27-12-10-26(11-13-27)19-4-6-20(7-5-19)29(32)33/h4-7,14-15,17H,8-13,16H2,1-3H3