(4-oxidanylidene-4-thiophen-2-yl-butyl) 2-methyl-1-phenyl-benzimidazole-5-carboxylate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 2-methyl-1-phenyl-benzimidazole-5-carboxylate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate CAS Name: 2-methyl-1-phenyl-5-benzimidazolecarboxylic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 2-methyl-1-phenylbenzimidazole-5-carboxylate Traditional Name: 2-methyl-1-phenyl-benzimidazole-5-carboxylic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)OCCCC(=O)C4=CC=CS4

Isomeric SMILES

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)OCCCC(=O)C4=CC=CS4

InChI

InChI=1S/C23H20N2O3S/c1-16-24-19-15-17(11-12-20(19)25(16)18-7-3-2-4-8-18)23(27)28-13-5-9-21(26)22-10-6-14-29-22/h2-4,6-8,10-12,14-15H,5,9,13H2,1H3