2-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-quinazolin-4-one

Systemtic Name: 2-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-quinazolin-4-one Openeye Name: 2-[2-(4-tert-butylphenyl)-2-oxo-ethyl]sulfanyl-3-methyl-quinazolin-4-one CAS Name: 2-[[2-(4-tert-butylphenyl)-2-oxoethyl]thio]-3-methyl-4-quinazolinone IUPAC Name: 2-[2-(4-tert-butylphenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one Traditional Name: 2-[[2-(4-tert-butylphenyl)-2-keto-ethyl]thio]-3-methyl-quinazolin-4-one Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C21H22N2O2S/c1-21(2,3)15-11-9-14(10-12-15)18(24)13-26-20-22-17-8-6-5-7-16(17)19(25)23(20)4/h5-12H,13H2,1-4H3