methyl 2-[[1-(4-aminocarbonylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[1-(4-aminocarbonylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[1-(4-carbamoylphenyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(4-carbamoylphenyl)-5-tetrazolyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[1-(4-carbamoylphenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-(4-carbamoylphenyl)tetrazol-5-yl]thio]acetic acid methyl ester Formula: C11H11N5O3S MolecularWeight: 293.30174

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NN=NN1C2=CC=C(C=C2)C(=O)N

Isomeric SMILES

COC(=O)CSC1=NN=NN1C2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C11H11N5O3S/c1-19-9(17)6-20-11-13-14-15-16(11)8-4-2-7(3-5-8)10(12)18/h2-5H,6H2,1H3,(H2,12,18)