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

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(2-propan-2-ylphenyl)quinazolin-4-one Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(2-isopropylphenyl)quinazolin-4-one CAS Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-3-(2-propan-2-ylphenyl)-4-quinazolinone IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-3-(2-propan-2-ylphenyl)quinazolin-4-one Traditional Name: 2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-3-o-cumenyl-quinazolin-4-one Formula: C30H34N2OS MolecularWeight: 470.66876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C(C)C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C(C)C)C)C(C)(C)C

InChI

InChI=1S/C30H34N2OS/c1-19(2)23-12-9-11-15-27(23)32-28(33)24-13-8-10-14-26(24)31-29(32)34-18-25-20(3)16-22(17-21(25)4)30(5,6)7/h8-17,19H,18H2,1-7H3