methyl 2-[2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanylethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanylethanoylamino]benzoate Openeye Name: methyl 2-[[2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]sulfanyl]acetyl]amino]benzoate CAS Name: 2-[[2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridinyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]thio]acetyl]amino]benzoic acid methyl ester Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C3=CN=C(C=C3)SCC(=O)NC4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C3=CN=C(C=C3)SCC(=O)NC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C24H22N4O3S/c1-14-10-19-20(11-15(14)2)28-23(27-19)16-8-9-22(25-12-16)32-13-21(29)26-18-7-5-4-6-17(18)24(30)31-3/h4-12H,13H2,1-3H3,(H,26,29)(H,27,28)