N-[3-[2-(cyanomethylsulfanyl)ethanoylamino]-2-methyl-phenyl]propanamide

Systemtic Name: N-[3-[2-(cyanomethylsulfanyl)ethanoylamino]-2-methyl-phenyl]propanamide Openeye Name: N-[3-[[2-(cyanomethylsulfanyl)acetyl]amino]-2-methyl-phenyl]propanamide CAS Name: N-[3-[[2-(cyanomethylthio)-1-oxoethyl]amino]-2-methylphenyl]propanamide IUPAC Name: N-[3-[[2-(cyanomethylsulfanyl)acetyl]amino]-2-methylphenyl]propanamide Traditional Name: N-[3-[[2-(cyanomethylthio)acetyl]amino]-2-methyl-phenyl]propionamide Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=CC=C1)NC(=O)CSCC#N)C

Isomeric SMILES

CCC(=O)NC1=C(C(=CC=C1)NC(=O)CSCC#N)C

InChI

InChI=1S/C14H17N3O2S/c1-3-13(18)16-11-5-4-6-12(10(11)2)17-14(19)9-20-8-7-15/h4-6H,3,8-9H2,1-2H3,(H,16,18)(H,17,19)