1-(4-chlorophenyl)-3-(2-methylsulfanyl-4-oxidanylidene-quinazolin-3-yl)thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-(2-methylsulfanyl-4-oxidanylidene-quinazolin-3-yl)thiourea Openeye Name: 1-(4-chlorophenyl)-3-(2-methylsulfanyl-4-oxo-quinazolin-3-yl)thiourea CAS Name: 1-(4-chlorophenyl)-3-[2-(methylthio)-4-oxo-3-quinazolinyl]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-(2-methylsulfanyl-4-oxoquinazolin-3-yl)thiourea Traditional Name: 1-(4-chlorophenyl)-3-[4-keto-2-(methylthio)quinazolin-3-yl]thiourea Formula: C16H13ClN4OS2 MolecularWeight: 376.88362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=CC=CC=C2C(=O)N1NC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=NC2=CC=CC=C2C(=O)N1NC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN4OS2/c1-24-16-19-13-5-3-2-4-12(13)14(22)21(16)20-15(23)18-11-8-6-10(17)7-9-11/h2-9H,1H3,(H2,18,20,23)