2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(4-propan-2-ylphenyl)quinazolin-4-one

Systemtic Name: 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(4-propan-2-ylphenyl)quinazolin-4-one Openeye Name: 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-3-(4-isopropylphenyl)quinazolin-4-one CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-3-(4-propan-2-ylphenyl)-4-quinazolinone IUPAC Name: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-(4-propan-2-ylphenyl)quinazolin-4-one Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-3-p-cumenyl-quinazolin-4-one Formula: C25H21ClN2O2S MolecularWeight: 448.96444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H21ClN2O2S/c1-16(2)17-9-13-20(14-10-17)28-24(30)21-5-3-4-6-22(21)27-25(28)31-15-23(29)18-7-11-19(26)12-8-18/h3-14,16H,15H2,1-2H3