2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(3,4-dimethoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(3,4-dimethoxyphenyl)quinazolin-4-one Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(3,4-dimethoxyphenyl)quinazolin-4-one CAS Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-3-(3,4-dimethoxyphenyl)-4-quinazolinone IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-3-(3,4-dimethoxyphenyl)quinazolin-4-one Traditional Name: 2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-3-(3,4-dimethoxyphenyl)quinazolin-4-one Formula: C29H32N2O3S MolecularWeight: 488.64098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)OC)OC)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)OC)OC)C)C(C)(C)C

InChI

InChI=1S/C29H32N2O3S/c1-18-14-20(29(3,4)5)15-19(2)23(18)17-35-28-30-24-11-9-8-10-22(24)27(32)31(28)21-12-13-25(33-6)26(16-21)34-7/h8-16H,17H2,1-7H3