N-[2-cyanoethyl(methyl)carbamothioyl]-4-methyl-benzamide

Systemtic Name: N-[2-cyanoethyl(methyl)carbamothioyl]-4-methyl-benzamide Openeye Name: N-[2-cyanoethyl(methyl)carbamothioyl]-4-methyl-benzamide CAS Name: N-[[2-cyanoethyl(methyl)amino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: N-[2-cyanoethyl(methyl)carbamothioyl]-4-methylbenzamide Traditional Name: N-[2-cyanoethyl(methyl)thiocarbamoyl]-4-methyl-benzamide Formula: C13H15N3OS MolecularWeight: 261.3427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)N(C)CCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)N(C)CCC#N

InChI

InChI=1S/C13H15N3OS/c1-10-4-6-11(7-5-10)12(17)15-13(18)16(2)9-3-8-14/h4-7H,3,9H2,1-2H3,(H,15,17,18)