methyl 2-[5,6-dimethyl-2-(thiophen-2-ylmethyl)benzimidazol-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[5,6-dimethyl-2-(thiophen-2-ylmethyl)benzimidazol-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[5,6-dimethyl-2-(2-thienylmethyl)benzimidazol-1-yl]sulfonylbenzoate CAS Name: 2-[[5,6-dimethyl-2-(thiophen-2-ylmethyl)-1-benzimidazolyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[5,6-dimethyl-2-(thiophen-2-ylmethyl)benzimidazol-1-yl]sulfonylbenzoate Traditional Name: 2-[5,6-dimethyl-2-(2-thenyl)benzimidazol-1-yl]sulfonylbenzoic acid methyl ester Formula: C22H20N2O4S2 MolecularWeight: 440.5352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)CC3=CC=CS3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)CC3=CC=CS3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C22H20N2O4S2/c1-14-11-18-19(12-15(14)2)24(21(23-18)13-16-7-6-10-29-16)30(26,27)20-9-5-4-8-17(20)22(25)28-3/h4-12H,13H2,1-3H3