5-[[4-(4-chlorophenyl)sulfanylphenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[4-(4-chlorophenyl)sulfanylphenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[4-(4-chlorophenyl)sulfanylphenyl]methylene]-1-cyclohexyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[4-[(4-chlorophenyl)thio]phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[4-(4-chlorophenyl)sulfanylphenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[4-[(4-chlorophenyl)thio]benzylidene]-1-cyclohexyl-barbituric acid Formula: C23H21ClN2O3S MolecularWeight: 440.94244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CC3=CC=C(C=C3)SC4=CC=C(C=C4)Cl)C(=O)NC2=O

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(=CC3=CC=C(C=C3)SC4=CC=C(C=C4)Cl)C(=O)NC2=O

InChI

InChI=1S/C23H21ClN2O3S/c24-16-8-12-19(13-9-16)30-18-10-6-15(7-11-18)14-20-21(27)25-23(29)26(22(20)28)17-4-2-1-3-5-17/h6-14,17H,1-5H2,(H,25,27,29)