N-butyl-N-[3-[4-(2-methylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]pyrazine-2-carboxamide

Systemtic Name: N-butyl-N-[3-[4-(2-methylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]pyrazine-2-carboxamide Openeye Name: N-butyl-N-[3-[4-(o-tolyl)piperazin-1-yl]-3-oxo-propyl]pyrazine-2-carboxamide CAS Name: N-butyl-N-[3-[4-(2-methylphenyl)-1-piperazinyl]-3-oxopropyl]-2-pyrazinecarboxamide IUPAC Name: N-butyl-N-[3-[4-(2-methylphenyl)piperazin-1-yl]-3-oxopropyl]pyrazine-2-carboxamide Traditional Name: N-butyl-N-[3-keto-3-[4-(o-tolyl)piperazino]propyl]pyrazinamide Formula: C23H31N5O2 MolecularWeight: 409.52454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)N1CCN(CC1)C2=CC=CC=C2C)C(=O)C3=NC=CN=C3

Isomeric SMILES

CCCCN(CCC(=O)N1CCN(CC1)C2=CC=CC=C2C)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C23H31N5O2/c1-3-4-12-28(23(30)20-18-24-10-11-25-20)13-9-22(29)27-16-14-26(15-17-27)21-8-6-5-7-19(21)2/h5-8,10-11,18H,3-4,9,12-17H2,1-2H3