N-(6-methylheptan-2-yl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(6-methylheptan-2-yl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,5-dimethylhexyl)-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(6-methylheptan-2-yl)-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(6-methylheptan-2-yl)-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(1,5-dimethylhexyl)-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]acetamide Formula: C19H27N3O2S MolecularWeight: 361.50158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C

Isomeric SMILES

CC(C)CCCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C

InChI

InChI=1S/C19H27N3O2S/c1-13(2)8-7-9-14(3)20-17(23)12-25-19-21-16-11-6-5-10-15(16)18(24)22(19)4/h5-6,10-11,13-14H,7-9,12H2,1-4H3,(H,20,23)