2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3-(4-methoxyphenyl)-6-methyl-quinazolin-4-one

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3-(4-methoxyphenyl)-6-methyl-quinazolin-4-one Openeye Name: 2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-3-(4-methoxyphenyl)-6-methyl-quinazolin-4-one CAS Name: 2-[(3,3-dimethyl-2-oxobutyl)thio]-3-(4-methoxyphenyl)-6-methyl-4-quinazolinone IUPAC Name: 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-3-(4-methoxyphenyl)-6-methylquinazolin-4-one Traditional Name: 2-[(2-keto-3,3-dimethyl-butyl)thio]-3-(4-methoxyphenyl)-6-methyl-quinazolin-4-one Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N(C2=O)C3=CC=C(C=C3)OC)SCC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N(C2=O)C3=CC=C(C=C3)OC)SCC(=O)C(C)(C)C

InChI

InChI=1S/C22H24N2O3S/c1-14-6-11-18-17(12-14)20(26)24(15-7-9-16(27-5)10-8-15)21(23-18)28-13-19(25)22(2,3)4/h6-12H,13H2,1-5H3