N-(2-cyanoethyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(2-cyanoethyl)-2-(1-phenyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(1-phenyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(1-phenyltetrazol-5-yl)thio]acetamide Formula: C12H12N6OS MolecularWeight: 288.32828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NCCC#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NCCC#N

InChI

InChI=1S/C12H12N6OS/c13-7-4-8-14-11(19)9-20-12-15-16-17-18(12)10-5-2-1-3-6-10/h1-3,5-6H,4,8-9H2,(H,14,19)