5-(2-methyl-4-oxidanylidene-pentan-2-yl)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-(2-methyl-4-oxidanylidene-pentan-2-yl)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(1,1-dimethyl-3-oxo-butyl)-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(2-methyl-4-oxopentan-2-yl)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(2-methyl-4-oxopentan-2-yl)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-keto-1,1-dimethyl-butyl)-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C)(C)C1C(=O)N(C(=S)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)CC(C)(C)C1C(=O)N(C(=S)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O3S/c1-15(25)14-22(2,3)18-19(26)23(16-10-6-4-7-11-16)21(28)24(20(18)27)17-12-8-5-9-13-17/h4-13,18H,14H2,1-3H3