methyl 4-(1-methylimidazol-2-yl)sulfanylbutanoate

Systemtic Name: methyl 4-(1-methylimidazol-2-yl)sulfanylbutanoate Openeye Name: methyl 4-(1-methylimidazol-2-yl)sulfanylbutanoate CAS Name: 4-[(1-methyl-2-imidazolyl)thio]butanoic acid methyl ester IUPAC Name: methyl 4-(1-methylimidazol-2-yl)sulfanylbutanoate Traditional Name: 4-[(1-methylimidazol-2-yl)thio]butyric acid methyl ester Formula: C9H14N2O2S MolecularWeight: 214.28466

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCCC(=O)OC

Isomeric SMILES

CN1C=CN=C1SCCCC(=O)OC

InChI

InChI=1S/C9H14N2O2S/c1-11-6-5-10-9(11)14-7-3-4-8(12)13-2/h5-6H,3-4,7H2,1-2H3