[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate CAS Name: 2-methyl-1-phenyl-5-benzimidazolecarboxylic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 2-methyl-1-phenylbenzimidazole-5-carboxylate Traditional Name: 2-methyl-1-phenyl-benzimidazole-5-carboxylic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)OCC(=O)NCC4=CC=CS4

Isomeric SMILES

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)OCC(=O)NCC4=CC=CS4

InChI

InChI=1S/C22H19N3O3S/c1-15-24-19-12-16(9-10-20(19)25(15)17-6-3-2-4-7-17)22(27)28-14-21(26)23-13-18-8-5-11-29-18/h2-12H,13-14H2,1H3,(H,23,26)