S-(1-phenyl-1,2,3,4-tetrazol-5-yl) 3-methoxybenzenecarbothioate

Systemtic Name: S-(1-phenyl-1,2,3,4-tetrazol-5-yl) 3-methoxybenzenecarbothioate Openeye Name: S-(1-phenyltetrazol-5-yl) 3-methoxybenzenecarbothioate CAS Name: 3-methoxybenzenecarbothioic acid S-(1-phenyl-5-tetrazolyl) ester IUPAC Name: S-(1-phenyltetrazol-5-yl) 3-methoxybenzenecarbothioate Traditional Name: 3-methoxythiobenzoic acid S-(1-phenyltetrazol-5-yl) ester Formula: C15H12N4O2S MolecularWeight: 312.34638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)SC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)SC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C15H12N4O2S/c1-21-13-9-5-6-11(10-13)14(20)22-15-16-17-18-19(15)12-7-3-2-4-8-12/h2-10H,1H3