3-(4-butan-2-ylphenyl)-7-chloranyl-2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-butan-2-ylphenyl)-7-chloranyl-2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-quinazolin-4-one Openeye Name: 7-chloro-2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-3-(4-sec-butylphenyl)quinazolin-4-one CAS Name: 3-(4-butan-2-ylphenyl)-7-chloro-2-[(3,3-dimethyl-2-oxobutyl)thio]-4-quinazolinone IUPAC Name: 3-(4-butan-2-ylphenyl)-7-chloro-2-(3,3-dimethyl-2-oxobutyl)sulfanylquinazolin-4-one Traditional Name: 7-chloro-2-[(2-keto-3,3-dimethyl-butyl)thio]-3-(4-sec-butylphenyl)quinazolin-4-one Formula: C24H27ClN2O2S MolecularWeight: 443.00138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)C(C)(C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)C(C)(C)C

InChI

InChI=1S/C24H27ClN2O2S/c1-6-15(2)16-7-10-18(11-8-16)27-22(29)19-12-9-17(25)13-20(19)26-23(27)30-14-21(28)24(3,4)5/h7-13,15H,6,14H2,1-5H3