(4-cyanopyridin-3-yl)methyl N-(2-ethylphenyl)sulfanylcarbamate

Systemtic Name: (4-cyanopyridin-3-yl)methyl N-(2-ethylphenyl)sulfanylcarbamate Openeye Name: (4-cyano-3-pyridyl)methyl N-(2-ethylphenyl)sulfanylcarbamate CAS Name: N-[(2-ethylphenyl)thio]carbamic acid (4-cyano-3-pyridinyl)methyl ester IUPAC Name: (4-cyanopyridin-3-yl)methyl N-(2-ethylphenyl)sulfanylcarbamate Traditional Name: N-[(2-ethylphenyl)thio]carbamic acid (4-cyano-3-pyridyl)methyl ester Formula: C16H15N3O2S MolecularWeight: 313.3742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1SNC(=O)OCC2=C(C=CN=C2)C#N

Isomeric SMILES

CCC1=CC=CC=C1SNC(=O)OCC2=C(C=CN=C2)C#N

InChI

InChI=1S/C16H15N3O2S/c1-2-12-5-3-4-6-15(12)22-19-16(20)21-11-14-10-18-8-7-13(14)9-17/h3-8,10H,2,11H2,1H3,(H,19,20)