ethyl 4-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]butanoate

Systemtic Name: ethyl 4-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]butanoate Openeye Name: ethyl 4-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]butanoate CAS Name: 4-[(5,6-dimethyl-1H-benzimidazol-2-yl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]butanoate Traditional Name: 4-[(5,6-dimethyl-1H-benzimidazol-2-yl)thio]butyric acid ethyl ester Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC2=C(N1)C=C(C(=C2)C)C

Isomeric SMILES

CCOC(=O)CCCSC1=NC2=C(N1)C=C(C(=C2)C)C

InChI

InChI=1S/C15H20N2O2S/c1-4-19-14(18)6-5-7-20-15-16-12-8-10(2)11(3)9-13(12)17-15/h8-9H,4-7H2,1-3H3,(H,16,17)