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

Systemtic Name: 1-cyclohexyl-5-[(2-phenylsulfanylphenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-cyclohexyl-5-[(2-phenylsulfanylphenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-cyclohexyl-5-[[2-(phenylthio)phenyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-cyclohexyl-5-[(2-phenylsulfanylphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-cyclohexyl-5-[2-(phenylthio)benzylidene]barbituric acid Formula: C23H22N2O3S MolecularWeight: 406.49738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CC3=CC=CC=C3SC4=CC=CC=C4)C(=O)NC2=O

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(=CC3=CC=CC=C3SC4=CC=CC=C4)C(=O)NC2=O

InChI

InChI=1S/C23H22N2O3S/c26-21-19(22(27)25(23(28)24-21)17-10-3-1-4-11-17)15-16-9-7-8-14-20(16)29-18-12-5-2-6-13-18/h2,5-9,12-15,17H,1,3-4,10-11H2,(H,24,26,28)