2-methyl-3-(5-phenyl-1,2,3,4-tetrazol-2-yl)propanethioamide

Systemtic Name: 2-methyl-3-(5-phenyl-1,2,3,4-tetrazol-2-yl)propanethioamide Openeye Name: 2-methyl-3-(5-phenyltetrazol-2-yl)propanethioamide CAS Name: 2-methyl-3-(5-phenyl-2-tetrazolyl)propanethioamide IUPAC Name: 2-methyl-3-(5-phenyltetrazol-2-yl)propanethioamide Traditional Name: 2-methyl-3-(5-phenyltetrazol-2-yl)thiopropionamide Formula: C11H13N5S MolecularWeight: 247.31942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1N=C(N=N1)C2=CC=CC=C2)C(=S)N

Isomeric SMILES

CC(CN1N=C(N=N1)C2=CC=CC=C2)C(=S)N

InChI

InChI=1S/C11H13N5S/c1-8(10(12)17)7-16-14-11(13-15-16)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H2,12,17)