2-(cyanomethylsulfanyl)-N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]benzamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]benzamide Openeye Name: 2-(cyanomethylsulfanyl)-N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]benzamide CAS Name: 2-(cyanomethylthio)-N-[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]benzamide IUPAC Name: 2-(cyanomethylsulfanyl)-N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]benzamide Traditional Name: 2-(cyanomethylthio)-N-[3-(cyclopropanecarbonylamino)benzyl]benzamide Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)C3=CC=CC=C3SCC#N

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)C3=CC=CC=C3SCC#N

InChI

InChI=1S/C20H19N3O2S/c21-10-11-26-18-7-2-1-6-17(18)20(25)22-13-14-4-3-5-16(12-14)23-19(24)15-8-9-15/h1-7,12,15H,8-9,11,13H2,(H,22,25)(H,23,24)