S-(1-methyl-1,2,3,4-tetrazol-5-yl) 3,4,5-trimethoxybenzenecarbothioate

Systemtic Name: S-(1-methyl-1,2,3,4-tetrazol-5-yl) 3,4,5-trimethoxybenzenecarbothioate Openeye Name: S-(1-methyltetrazol-5-yl) 3,4,5-trimethoxybenzenecarbothioate CAS Name: 3,4,5-trimethoxybenzenecarbothioic acid S-(1-methyl-5-tetrazolyl) ester IUPAC Name: S-(1-methyltetrazol-5-yl) 3,4,5-trimethoxybenzenecarbothioate Traditional Name: 3,4,5-trimethoxythiobenzoic acid S-(1-methyltetrazol-5-yl) ester Formula: C12H14N4O4S MolecularWeight: 310.32896

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CN1C(=NN=N1)SC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C12H14N4O4S/c1-16-12(13-14-15-16)21-11(17)7-5-8(18-2)10(20-4)9(6-7)19-3/h5-6H,1-4H3