N-(3-methylphenyl)-6-oxidanylidene-2-(4-phenylpiperazin-1-yl)-4,5-dihydro-1H-pyrimidine-4-carboxamide

Systemtic Name: N-(3-methylphenyl)-6-oxidanylidene-2-(4-phenylpiperazin-1-yl)-4,5-dihydro-1H-pyrimidine-4-carboxamide Openeye Name: N-(m-tolyl)-6-oxo-2-(4-phenylpiperazin-1-yl)-4,5-dihydro-1H-pyrimidine-4-carboxamide CAS Name: N-(3-methylphenyl)-6-oxo-2-(4-phenyl-1-piperazinyl)-4,5-dihydro-1H-pyrimidine-4-carboxamide IUPAC Name: N-(3-methylphenyl)-6-oxo-2-(4-phenylpiperazin-1-yl)-4,5-dihydro-1H-pyrimidine-4-carboxamide Traditional Name: 6-keto-N-(m-tolyl)-2-(4-phenylpiperazino)-4,5-dihydro-1H-pyrimidine-4-carboxamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2CC(=O)NC(=N2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2CC(=O)NC(=N2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5O2/c1-16-6-5-7-17(14-16)23-21(29)19-15-20(28)25-22(24-19)27-12-10-26(11-13-27)18-8-3-2-4-9-18/h2-9,14,19H,10-13,15H2,1H3,(H,23,29)(H,24,25,28)