ethyl 5-ethanoyl-2-[2-(2-ethylbenzimidazol-1-yl)ethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-2-[2-(2-ethylbenzimidazol-1-yl)ethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[[2-(2-ethylbenzimidazol-1-yl)acetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[2-(2-ethyl-1-benzimidazolyl)-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[[2-(2-ethylbenzimidazol-1-yl)acetyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[2-(2-ethylbenzimidazol-1-yl)acetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2N1CC(=O)NC3=C(C(=C(S3)C(=O)C)C)C(=O)OCC

Isomeric SMILES

CCC1=NC2=CC=CC=C2N1CC(=O)NC3=C(C(=C(S3)C(=O)C)C)C(=O)OCC

InChI

InChI=1S/C21H23N3O4S/c1-5-16-22-14-9-7-8-10-15(14)24(16)11-17(26)23-20-18(21(27)28-6-2)12(3)19(29-20)13(4)25/h7-10H,5-6,11H2,1-4H3,(H,23,26)