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

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC)C

InChI

InChI=1S/C21H23N3O2S/c1-4-15-10-8-9-14(3)19(15)23-18(25)13-27-21-22-17-12-7-6-11-16(17)20(26)24(21)5-2/h6-12H,4-5,13H2,1-3H3,(H,23,25)