2-(cyanomethylsulfanyl)-N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(cyanomethylsulfanyl)-N-[[4-(indolin-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-(cyanomethylthio)-N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(cyanomethylsulfanyl)-N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(cyanomethylthio)-N-[4-(indolin-1-ylmethyl)benzyl]acetamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)CC3=CC=C(C=C3)CNC(=O)CSCC#N

Isomeric SMILES

C1CN(C2=CC=CC=C21)CC3=CC=C(C=C3)CNC(=O)CSCC#N

InChI

InChI=1S/C20H21N3OS/c21-10-12-25-15-20(24)22-13-16-5-7-17(8-6-16)14-23-11-9-18-3-1-2-4-19(18)23/h1-8H,9,11-15H2,(H,22,24)