N-(2-cyanoethyl)-N-methyl-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-methyl-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-N-methyl-2-(3-methyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-[(3-methyl-4-oxo-2-benzo[g]quinazolinyl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-2-(3-methyl-4-oxobenzo[g]quinazolin-2-yl)sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(4-keto-3-methyl-benzo[g]quinazolin-2-yl)thio]-N-methyl-acetamide Formula: C19H18N4O2S MolecularWeight: 366.43682

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)N(C)CCC#N

Isomeric SMILES

CN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)N(C)CCC#N

InChI

InChI=1S/C19H18N4O2S/c1-22(9-5-8-20)17(24)12-26-19-21-16-11-14-7-4-3-6-13(14)10-15(16)18(25)23(19)2/h3-4,6-7,10-11H,5,9,12H2,1-2H3