(4S)-N-(3,4-dimethylphenyl)-2-[(4-methylphenyl)amino]-6-oxidanylidene-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide

Systemtic Name: (4S)-N-(3,4-dimethylphenyl)-2-[(4-methylphenyl)amino]-6-oxidanylidene-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide Openeye Name: (4S)-N-(3,4-dimethylphenyl)-2-(4-methylanilino)-6-oxo-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide CAS Name: (4S)-N-(3,4-dimethylphenyl)-2-(4-methylanilino)-6-oxo-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide IUPAC Name: (4S)-N-(3,4-dimethylphenyl)-2-(4-methylanilino)-6-oxo-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide Traditional Name: (4S)-N-(3,4-dimethylphenyl)-6-keto-2-(p-toluidino)-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide Formula: C20H23N4O2+ MolecularWeight: 351.42222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=[NH+]C(CC(=O)N2)C(=O)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=[NH+][C@@H](CC(=O)N2)C(=O)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C20H22N4O2/c1-12-4-7-15(8-5-12)22-20-23-17(11-18(25)24-20)19(26)21-16-9-6-13(2)14(3)10-16/h4-10,17H,11H2,1-3H3,(H,21,26)(H2,22,23,24,25)/p+1/t17-/m0/s1