[2-[(1,4-dimethylimidazol-2-yl)sulfanylmethyl]-1-benzothiophen-3-yl] ethanoate

Systemtic Name: [2-[(1,4-dimethylimidazol-2-yl)sulfanylmethyl]-1-benzothiophen-3-yl] ethanoate Openeye Name: [2-[(1,4-dimethylimidazol-2-yl)sulfanylmethyl]benzothiophen-3-yl] acetate CAS Name: acetic acid [2-[[(1,4-dimethyl-2-imidazolyl)thio]methyl]-1-benzothiophen-3-yl] ester IUPAC Name: [2-[(1,4-dimethylimidazol-2-yl)sulfanylmethyl]-1-benzothiophen-3-yl] acetate Traditional Name: acetic acid [2-[[(1,4-dimethylimidazol-2-yl)thio]methyl]benzothiophen-3-yl] ester Formula: C16H16N2O2S2 MolecularWeight: 332.44044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=N1)SCC2=C(C3=CC=CC=C3S2)OC(=O)C)C

Isomeric SMILES

CC1=CN(C(=N1)SCC2=C(C3=CC=CC=C3S2)OC(=O)C)C

InChI

InChI=1S/C16H16N2O2S2/c1-10-8-18(3)16(17-10)21-9-14-15(20-11(2)19)12-6-4-5-7-13(12)22-14/h4-8H,9H2,1-3H3