(5S)-1-(2-methylphenyl)-5-(2-piperidin-1-ylethyliminomethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: (5S)-1-(2-methylphenyl)-5-(2-piperidin-1-ylethyliminomethyl)-1,3-diazinane-2,4,6-trione Openeye Name: (5S)-1-(o-tolyl)-5-[2-(1-piperidyl)ethyliminomethyl]hexahydropyrimidine-2,4,6-trione CAS Name: (5S)-1-(2-methylphenyl)-5-[2-(1-piperidinyl)ethyliminomethyl]-1,3-diazinane-2,4,6-trione IUPAC Name: (5S)-1-(2-methylphenyl)-5-(2-piperidin-1-ylethyliminomethyl)-1,3-diazinane-2,4,6-trione Traditional Name: (5S)-1-(o-tolyl)-5-(2-piperidinoethyliminomethyl)barbituric acid Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(C(=O)NC2=O)C=NCCN3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)[C@H](C(=O)NC2=O)C=NCCN3CCCCC3

InChI

InChI=1S/C19H24N4O3/c1-14-7-3-4-8-16(14)23-18(25)15(17(24)21-19(23)26)13-20-9-12-22-10-5-2-6-11-22/h3-4,7-8,13,15H,2,5-6,9-12H2,1H3,(H,21,24,26)/t15-/m0/s1