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

Systemtic Name: propan-2-yl 2-[[1-(3-acetamidophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: isopropyl 2-[1-(3-acetamidophenyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(3-acetamidophenyl)-5-tetrazolyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[1-(3-acetamidophenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-(3-acetamidophenyl)tetrazol-5-yl]thio]acetic acid isopropyl ester Formula: C14H17N5O3S MolecularWeight: 335.38148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N5O3S/c1-9(2)22-13(21)8-23-14-16-17-18-19(14)12-6-4-5-11(7-12)15-10(3)20/h4-7,9H,8H2,1-3H3,(H,15,20)