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

Systemtic Name: N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-(phenylmethyl)pyrazine-2-carboxamide Openeye Name: N-benzyl-N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxo-propyl]pyrazine-2-carboxamide CAS Name: N-[3-[4-(4-nitrophenyl)-1-piperazinyl]-3-oxopropyl]-N-(phenylmethyl)-2-pyrazinecarboxamide IUPAC Name: N-benzyl-N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropyl]pyrazine-2-carboxamide Traditional Name: N-benzyl-N-[3-keto-3-[4-(4-nitrophenyl)piperazino]propyl]pyrazinamide Formula: C25H26N6O4 MolecularWeight: 474.51174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCN(CC3=CC=CC=C3)C(=O)C4=NC=CN=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCN(CC3=CC=CC=C3)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C25H26N6O4/c32-24(29-16-14-28(15-17-29)21-6-8-22(9-7-21)31(34)35)10-13-30(19-20-4-2-1-3-5-20)25(33)23-18-26-11-12-27-23/h1-9,11-12,18H,10,13-17,19H2