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

Systemtic Name: cyclohexyl 2-[[1-(4-acetamidophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: cyclohexyl 2-[1-(4-acetamidophenyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(4-acetamidophenyl)-5-tetrazolyl]thio]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[1-(4-acetamidophenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-(4-acetamidophenyl)tetrazol-5-yl]thio]acetic acid cyclohexyl ester Formula: C17H21N5O3S MolecularWeight: 375.44534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)OC3CCCCC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)OC3CCCCC3

InChI

InChI=1S/C17H21N5O3S/c1-12(23)18-13-7-9-14(10-8-13)22-17(19-20-21-22)26-11-16(24)25-15-5-3-2-4-6-15/h7-10,15H,2-6,11H2,1H3,(H,18,23)