methyl 3-[[1-(2-methylcyclohexyl)-1,2,3,4-tetrazol-5-yl]methylsulfanyl]propanoate

Systemtic Name: methyl 3-[[1-(2-methylcyclohexyl)-1,2,3,4-tetrazol-5-yl]methylsulfanyl]propanoate Openeye Name: methyl 3-[[1-(2-methylcyclohexyl)tetrazol-5-yl]methylsulfanyl]propanoate CAS Name: 3-[[1-(2-methylcyclohexyl)-5-tetrazolyl]methylthio]propanoic acid methyl ester IUPAC Name: methyl 3-[[1-(2-methylcyclohexyl)tetrazol-5-yl]methylsulfanyl]propanoate Traditional Name: 3-[[1-(2-methylcyclohexyl)tetrazol-5-yl]methylthio]propionic acid methyl ester Formula: C13H22N4O2S MolecularWeight: 298.40438

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N2C(=NN=N2)CSCCC(=O)OC

Isomeric SMILES

CC1CCCCC1N2C(=NN=N2)CSCCC(=O)OC

InChI

InChI=1S/C13H22N4O2S/c1-10-5-3-4-6-11(10)17-12(14-15-16-17)9-20-8-7-13(18)19-2/h10-11H,3-9H2,1-2H3