methyl 2-butyl-3-[(3-chloranyl-2-methoxycarbonyl-1-benzothiophen-6-yl)methyl]benzimidazole-4-carboxylate

Systemtic Name: methyl 2-butyl-3-[(3-chloranyl-2-methoxycarbonyl-1-benzothiophen-6-yl)methyl]benzimidazole-4-carboxylate Openeye Name: methyl 2-butyl-3-[(3-chloro-2-methoxycarbonyl-benzothiophen-6-yl)methyl]benzimidazole-4-carboxylate CAS Name: 2-butyl-3-[(3-chloro-2-methoxycarbonyl-1-benzothiophen-6-yl)methyl]-4-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-butyl-3-[(3-chloro-2-methoxycarbonyl-1-benzothiophen-6-yl)methyl]benzimidazole-4-carboxylate Traditional Name: 2-butyl-3-[(2-carbomethoxy-3-chloro-benzothiophen-6-yl)methyl]benzimidazole-4-carboxylic acid methyl ester Formula: C24H23ClN2O4S MolecularWeight: 470.96842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC(=C2N1CC3=CC4=C(C=C3)C(=C(S4)C(=O)OC)Cl)C(=O)OC

Isomeric SMILES

CCCCC1=NC2=CC=CC(=C2N1CC3=CC4=C(C=C3)C(=C(S4)C(=O)OC)Cl)C(=O)OC

InChI

InChI=1S/C24H23ClN2O4S/c1-4-5-9-19-26-17-8-6-7-16(23(28)30-2)21(17)27(19)13-14-10-11-15-18(12-14)32-22(20(15)25)24(29)31-3/h6-8,10-12H,4-5,9,13H2,1-3H3