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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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