3-[[1-(4-methylcyclohexyl)-1,2,3,4-tetrazol-5-yl]methylsulfanyl]propanoic acid

Systemtic Name: 3-[[1-(4-methylcyclohexyl)-1,2,3,4-tetrazol-5-yl]methylsulfanyl]propanoic acid Openeye Name: 3-[[1-(4-methylcyclohexyl)tetrazol-5-yl]methylsulfanyl]propanoic acid CAS Name: 3-[[1-(4-methylcyclohexyl)-5-tetrazolyl]methylthio]propanoic acid IUPAC Name: 3-[[1-(4-methylcyclohexyl)tetrazol-5-yl]methylsulfanyl]propanoic acid Traditional Name: 3-[[1-(4-methylcyclohexyl)tetrazol-5-yl]methylthio]propionic acid Formula: C12H20N4O2S MolecularWeight: 284.3778

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N2C(=NN=N2)CSCCC(=O)O

Isomeric SMILES

CC1CCC(CC1)N2C(=NN=N2)CSCCC(=O)O

InChI

InChI=1S/C12H20N4O2S/c1-9-2-4-10(5-3-9)16-11(13-14-15-16)8-19-7-6-12(17)18/h9-10H,2-8H2,1H3,(H,17,18)