(4S)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(3-methylphenyl)-6-oxidanylidene-4,5-dihydropyrimidine-4-carboxylate

Systemtic Name: (4S)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(3-methylphenyl)-6-oxidanylidene-4,5-dihydropyrimidine-4-carboxylate Openeye Name: (4S)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(m-tolyl)-6-oxo-4,5-dihydropyrimidine-4-carboxylate CAS Name: (4S)-2-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-(3-methylphenyl)-6-oxo-4,5-dihydropyrimidine-4-carboxylate IUPAC Name: (4S)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(3-methylphenyl)-6-oxo-4,5-dihydropyrimidine-4-carboxylate Traditional Name: (4S)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-keto-3-(m-tolyl)-4,5-dihydropyrimidine-4-carboxylate Formula: C18H18N5O3- MolecularWeight: 352.36722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(CC(=O)N=C2NC3=NC(=CC(=N3)C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2[C@@H](CC(=O)N=C2NC3=NC(=CC(=N3)C)C)C(=O)[O-]

InChI

InChI=1S/C18H19N5O3/c1-10-5-4-6-13(7-10)23-14(16(25)26)9-15(24)21-18(23)22-17-19-11(2)8-12(3)20-17/h4-8,14H,9H2,1-3H3,(H,25,26)(H,19,20,21,22,24)/p-1/t14-/m0/s1