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

Systemtic Name: butyl 2-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: butyl 2-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(4-methoxyphenyl)-5-tetrazolyl]thio]acetic acid butyl ester IUPAC Name: butyl 2-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-(4-methoxyphenyl)tetrazol-5-yl]thio]acetic acid butyl ester Formula: C14H18N4O3S MolecularWeight: 322.38272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O3S/c1-3-4-9-21-13(19)10-22-14-15-16-17-18(14)11-5-7-12(20-2)8-6-11/h5-8H,3-4,9-10H2,1-2H3