N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-4-[(phenylthio)methyl]benzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-4-(phenylsulfanylmethyl)benzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-4-[(phenylthio)methyl]benzamide Formula: C22H18N2OS MolecularWeight: 358.45612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C22H18N2OS/c23-15-14-17-8-12-20(13-9-17)24-22(25)19-10-6-18(7-11-19)16-26-21-4-2-1-3-5-21/h1-13H,14,16H2,(H,24,25)