N-[4-(cyanomethyl)phenyl]-2-methoxy-4-methylsulfanyl-benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-4-methylsulfanyl-benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-4-methylsulfanyl-benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-4-(methylthio)benzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-4-methylsulfanylbenzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-methoxy-4-(methylthio)benzamide Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)NC2=CC=C(C=C2)CC#N

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)NC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C17H16N2O2S/c1-21-16-11-14(22-2)7-8-15(16)17(20)19-13-5-3-12(4-6-13)9-10-18/h3-8,11H,9H2,1-2H3,(H,19,20)