N-[3-[(4-methylphenyl)amino]-3-oxidanylidene-propyl]-N-(phenylmethyl)pyrazine-2-carboxamide

Systemtic Name: N-[3-[(4-methylphenyl)amino]-3-oxidanylidene-propyl]-N-(phenylmethyl)pyrazine-2-carboxamide Openeye Name: N-benzyl-N-[3-(4-methylanilino)-3-oxo-propyl]pyrazine-2-carboxamide CAS Name: N-[3-(4-methylanilino)-3-oxopropyl]-N-(phenylmethyl)-2-pyrazinecarboxamide IUPAC Name: N-benzyl-N-[3-(4-methylanilino)-3-oxopropyl]pyrazine-2-carboxamide Traditional Name: N-benzyl-N-[3-keto-3-(p-toluidino)propyl]pyrazinamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCN(CC2=CC=CC=C2)C(=O)C3=NC=CN=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCN(CC2=CC=CC=C2)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C22H22N4O2/c1-17-7-9-19(10-8-17)25-21(27)11-14-26(16-18-5-3-2-4-6-18)22(28)20-15-23-12-13-24-20/h2-10,12-13,15H,11,14,16H2,1H3,(H,25,27)