(5S)-5-(C-methyl-N-phenethyl-carbonimidoyl)-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: (5S)-5-(C-methyl-N-phenethyl-carbonimidoyl)-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: (5S)-5-(C-methyl-N-phenethyl-carbonimidoyl)-1-(p-tolyl)hexahydropyrimidine-2,4,6-trione CAS Name: (5S)-1-(4-methylphenyl)-5-(1-phenethyliminoethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: (5S)-5-(C-methyl-N-phenethylcarbonimidoyl)-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: (5S)-5-(C-methyl-N-phenethyl-carbonimidoyl)-1-(p-tolyl)barbituric acid Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=O)C(=NCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)[C@H](C(=O)NC2=O)C(=NCCC3=CC=CC=C3)C

InChI

InChI=1S/C21H21N3O3/c1-14-8-10-17(11-9-14)24-20(26)18(19(25)23-21(24)27)15(2)22-13-12-16-6-4-3-5-7-16/h3-11,18H,12-13H2,1-2H3,(H,23,25,27)/t18-/m0/s1