ethyl 2-[2-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-pyridin-4-yl]sulfanylethyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]ethanoate

Systemtic Name: ethyl 2-[2-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-pyridin-4-yl]sulfanylethyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]ethanoate Openeye Name: ethyl 2-[2-[[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-4-pyridyl]sulfanyl]ethyl-(2-ethoxy-2-oxo-ethyl)amino]acetate CAS Name: 2-[2-[[2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridinyl]thio]ethyl-(2-ethoxy-2-oxoethyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methylpyridin-4-yl]sulfanylethyl-(2-ethoxy-2-oxoethyl)amino]acetate Traditional Name: 2-[2-[[2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridyl]thio]ethyl-(2-ethoxy-2-keto-ethyl)amino]acetic acid ethyl ester Formula: C24H30N4O4S2 MolecularWeight: 502.6494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CCSC1=C(C(=NC=C1)CSC2=NC3=CC=CC=C3N2)C)CC(=O)OCC

Isomeric SMILES

CCOC(=O)CN(CCSC1=C(C(=NC=C1)CSC2=NC3=CC=CC=C3N2)C)CC(=O)OCC

InChI

InChI=1S/C24H30N4O4S2/c1-4-31-22(29)14-28(15-23(30)32-5-2)12-13-33-21-10-11-25-20(17(21)3)16-34-24-26-18-8-6-7-9-19(18)27-24/h6-11H,4-5,12-16H2,1-3H3,(H,26,27)