(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl N-(methylamino)carbamate

Systemtic Name: (4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl N-(methylamino)carbamate Openeye Name: (4-phenyl-5-thioxo-tetrazol-1-yl)methyl N-(methylamino)carbamate CAS Name: N-(methylamino)carbamic acid (4-phenyl-5-sulfanylidene-1-tetrazolyl)methyl ester IUPAC Name: (4-phenyl-5-sulfanylidenetetrazol-1-yl)methyl N-(methylamino)carbamate Traditional Name: N-(methylamino)carbamic acid (4-phenyl-5-thioxo-tetrazol-1-yl)methyl ester Formula: C10H12N6O2S MolecularWeight: 280.30628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNNC(=O)OCN1C(=S)N(N=N1)C2=CC=CC=C2

Isomeric SMILES

CNNC(=O)OCN1C(=S)N(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C10H12N6O2S/c1-11-12-9(17)18-7-15-10(19)16(14-13-15)8-5-3-2-4-6-8/h2-6,11H,7H2,1H3,(H,12,17)