[3-methyl-4-[2-(4-methylphenyl)sulfanylethanoylamino]phenyl] thiocyanate

Systemtic Name: [3-methyl-4-[2-(4-methylphenyl)sulfanylethanoylamino]phenyl] thiocyanate Openeye Name: [3-methyl-4-[[2-(p-tolylsulfanyl)acetyl]amino]phenyl] thiocyanate CAS Name: thiocyanic acid [3-methyl-4-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]phenyl] ester IUPAC Name: [3-methyl-4-[[2-(4-methylphenyl)sulfanylacetyl]amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [3-methyl-4-[[2-(p-tolylthio)acetyl]amino]phenyl] ester Formula: C17H16N2OS2 MolecularWeight: 328.45174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)SC#N)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)SC#N)C

InChI

InChI=1S/C17H16N2OS2/c1-12-3-5-14(6-4-12)21-10-17(20)19-16-8-7-15(22-11-18)9-13(16)2/h3-9H,10H2,1-2H3,(H,19,20)