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

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(2-methoxyphenyl)quinazolin-4-one Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(2-methoxyphenyl)quinazolin-4-one CAS Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-3-(2-methoxyphenyl)-4-quinazolinone IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-3-(2-methoxyphenyl)quinazolin-4-one Traditional Name: 2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-3-(2-methoxyphenyl)quinazolin-4-one Formula: C28H30N2O2S MolecularWeight: 458.615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4OC)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4OC)C)C(C)(C)C

InChI

InChI=1S/C28H30N2O2S/c1-18-15-20(28(3,4)5)16-19(2)22(18)17-33-27-29-23-12-8-7-11-21(23)26(31)30(27)24-13-9-10-14-25(24)32-6/h7-16H,17H2,1-6H3