methyl 4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]butanoate

Systemtic Name: methyl 4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]butanoate Openeye Name: methyl 4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]butanoate CAS Name: 4-[(6-methoxy-1H-benzimidazol-2-yl)thio]butanoic acid methyl ester IUPAC Name: methyl 4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]butanoate Traditional Name: 4-[(6-methoxy-1H-benzimidazol-2-yl)thio]butyric acid methyl ester Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCCCC(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCCCC(=O)OC

InChI

InChI=1S/C13H16N2O3S/c1-17-9-5-6-10-11(8-9)15-13(14-10)19-7-3-4-12(16)18-2/h5-6,8H,3-4,7H2,1-2H3,(H,14,15)