methyl 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]butanoate

Systemtic Name: methyl 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]butanoate Openeye Name: methyl 4-(4-methylthiazol-2-yl)sulfanylbutanoate CAS Name: 4-[(4-methyl-2-thiazolyl)thio]butanoic acid methyl ester IUPAC Name: methyl 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]butanoate Traditional Name: 4-[(4-methylthiazol-2-yl)thio]butyric acid methyl ester Formula: C9H13NO2S2 MolecularWeight: 231.33502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCCCC(=O)OC

Isomeric SMILES

CC1=CSC(=N1)SCCCC(=O)OC

InChI

InChI=1S/C9H13NO2S2/c1-7-6-14-9(10-7)13-5-3-4-8(11)12-2/h6H,3-5H2,1-2H3