N-(2-cyanoethyl)-2-methoxy-4-methylsulfanyl-N-phenyl-benzamide

Systemtic Name: N-(2-cyanoethyl)-2-methoxy-4-methylsulfanyl-N-phenyl-benzamide Openeye Name: N-(2-cyanoethyl)-2-methoxy-4-methylsulfanyl-N-phenyl-benzamide CAS Name: N-(2-cyanoethyl)-2-methoxy-4-(methylthio)-N-phenylbenzamide IUPAC Name: N-(2-cyanoethyl)-2-methoxy-4-methylsulfanyl-N-phenylbenzamide Traditional Name: N-(2-cyanoethyl)-2-methoxy-4-(methylthio)-N-phenyl-benzamide Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)N(CCC#N)C2=CC=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)N(CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C18H18N2O2S/c1-22-17-13-15(23-2)9-10-16(17)18(21)20(12-6-11-19)14-7-4-3-5-8-14/h3-5,7-10,13H,6,12H2,1-2H3