1-(3-chlorophenyl)-3-[3-methoxy-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[3-methoxy-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]thiourea Openeye Name: 1-(3-chlorophenyl)-3-[3-methoxy-4-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]thiourea CAS Name: 1-(3-chlorophenyl)-3-[3-methoxy-4-(2-methyl-4-oxo-3-quinazolinyl)phenyl]thiourea IUPAC Name: 1-(3-chlorophenyl)-3-[3-methoxy-4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]thiourea Traditional Name: 1-(3-chlorophenyl)-3-[4-(4-keto-2-methyl-quinazolin-3-yl)-3-methoxy-phenyl]thiourea Formula: C23H19ClN4O2S MolecularWeight: 450.94056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=C(C=C(C=C3)NC(=S)NC4=CC(=CC=C4)Cl)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=C(C=C(C=C3)NC(=S)NC4=CC(=CC=C4)Cl)OC

InChI

InChI=1S/C23H19ClN4O2S/c1-14-25-19-9-4-3-8-18(19)22(29)28(14)20-11-10-17(13-21(20)30-2)27-23(31)26-16-7-5-6-15(24)12-16/h3-13H,1-2H3,(H2,26,27,31)