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

Systemtic Name: propan-2-yl 2-[[1-(3-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: isopropyl 2-[1-(3-methoxyphenyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(3-methoxyphenyl)-5-tetrazolyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[1-(3-methoxyphenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-(3-methoxyphenyl)tetrazol-5-yl]thio]acetic acid isopropyl ester Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N4O3S/c1-9(2)20-12(18)8-21-13-14-15-16-17(13)10-5-4-6-11(7-10)19-3/h4-7,9H,8H2,1-3H3