1,3-bis(4-methylphenyl)-5-(2-phenylethanoyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1,3-bis(4-methylphenyl)-5-(2-phenylethanoyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(2-phenylacetyl)-1,3-bis(p-tolyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1,3-bis(4-methylphenyl)-5-(1-oxo-2-phenylethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1,3-bis(4-methylphenyl)-5-(2-phenylacetyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(2-phenylacetyl)-1,3-bis(p-tolyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C26H22N2O3S MolecularWeight: 442.52948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(C(=O)N(C2=S)C3=CC=C(C=C3)C)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(C(=O)N(C2=S)C3=CC=C(C=C3)C)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H22N2O3S/c1-17-8-12-20(13-9-17)27-24(30)23(22(29)16-19-6-4-3-5-7-19)25(31)28(26(27)32)21-14-10-18(2)11-15-21/h3-15,23H,16H2,1-2H3