1-(4-methylphenyl)-5-(2-pyridin-2-ylethyl)-5-(thiophen-2-ylmethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(4-methylphenyl)-5-(2-pyridin-2-ylethyl)-5-(thiophen-2-ylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 1-(p-tolyl)-5-[2-(2-pyridyl)ethyl]-5-(2-thienylmethyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-methylphenyl)-5-[2-(2-pyridinyl)ethyl]-5-(thiophen-2-ylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-methylphenyl)-5-(2-pyridin-2-ylethyl)-5-(thiophen-2-ylmethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1-(p-tolyl)-5-[2-(2-pyridyl)ethyl]-5-(2-thenyl)barbituric acid Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=O)(CCC3=CC=CC=N3)CC4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=O)(CCC3=CC=CC=N3)CC4=CC=CS4

InChI

InChI=1S/C23H21N3O3S/c1-16-7-9-18(10-8-16)26-21(28)23(20(27)25-22(26)29,15-19-6-4-14-30-19)12-11-17-5-2-3-13-24-17/h2-10,13-14H,11-12,15H2,1H3,(H,25,27,29)