methyl 4-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butanoate

Systemtic Name: methyl 4-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butanoate Openeye Name: methyl 4-(1-cyclohexyltetrazol-5-yl)sulfanylbutanoate CAS Name: 4-[(1-cyclohexyl-5-tetrazolyl)thio]butanoic acid methyl ester IUPAC Name: methyl 4-(1-cyclohexyltetrazol-5-yl)sulfanylbutanoate Traditional Name: 4-[(1-cyclohexyltetrazol-5-yl)thio]butyric acid methyl ester Formula: C12H20N4O2S MolecularWeight: 284.3778

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC1=NN=NN1C2CCCCC2

Isomeric SMILES

COC(=O)CCCSC1=NN=NN1C2CCCCC2

InChI

InChI=1S/C12H20N4O2S/c1-18-11(17)8-5-9-19-12-13-14-15-16(12)10-6-3-2-4-7-10/h10H,2-9H2,1H3