ethyl 4,5-dimethyl-2-[2-(2-propan-2-ylbenzimidazol-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[2-(2-propan-2-ylbenzimidazol-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-isopropylbenzimidazol-1-yl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-(2-propan-2-yl-1-benzimidazolyl)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[2-(2-propan-2-ylbenzimidazol-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(2-isopropylbenzimidazol-1-yl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C3=CC=CC=C3N=C2C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C3=CC=CC=C3N=C2C(C)C

InChI

InChI=1S/C21H25N3O3S/c1-6-27-21(26)18-13(4)14(5)28-20(18)23-17(25)11-24-16-10-8-7-9-15(16)22-19(24)12(2)3/h7-10,12H,6,11H2,1-5H3,(H,23,25)