N-[1-(4-chlorophenyl)-2-methyl-propyl]-2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(4-chlorophenyl)-2-methyl-propyl]-2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-(4-chlorophenyl)-2-methyl-propyl]-2-(3,6-dimethyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[1-(4-chlorophenyl)-2-methylpropyl]-2-[(3,6-dimethyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-[1-(4-chlorophenyl)-2-methylpropyl]-2-(3,6-dimethyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[1-(4-chlorophenyl)-2-methyl-propyl]-2-[(4-keto-3,6-dimethyl-quinazolin-2-yl)thio]acetamide Formula: C22H24ClN3O2S MolecularWeight: 429.96286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24ClN3O2S/c1-13(2)20(15-6-8-16(23)9-7-15)25-19(27)12-29-22-24-18-10-5-14(3)11-17(18)21(28)26(22)4/h5-11,13,20H,12H2,1-4H3,(H,25,27)