propan-2-yl 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoate

Systemtic Name: propan-2-yl 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoate Openeye Name: isopropyl 2-(1-phenyltetrazol-5-yl)sulfanylacetate CAS Name: 2-[(1-phenyl-5-tetrazolyl)thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(1-phenyltetrazol-5-yl)sulfanylacetate Traditional Name: 2-[(1-phenyltetrazol-5-yl)thio]acetic acid isopropyl ester Formula: C12H14N4O2S MolecularWeight: 278.33016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CSC1=NN=NN1C2=CC=CC=C2

Isomeric SMILES

CC(C)OC(=O)CSC1=NN=NN1C2=CC=CC=C2

InChI

InChI=1S/C12H14N4O2S/c1-9(2)18-11(17)8-19-12-13-14-15-16(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3