ethyl 5-aminocarbonyl-2-[2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanylethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-2-[2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanylethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-2-[[2-(5-chloro-1-propyl-benzimidazol-2-yl)sulfanylacetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-2-[[2-[(5-chloro-1-propyl-2-benzimidazolyl)thio]-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-2-[[2-(5-chloro-1-propylbenzimidazol-2-yl)sulfanylacetyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[[2-[(5-chloro-1-propyl-benzimidazol-2-yl)thio]acetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H23ClN4O4S2 MolecularWeight: 495.01472

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=C(C(=C(S3)C(=O)N)C)C(=O)OCC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=C(C(=C(S3)C(=O)N)C)C(=O)OCC

InChI

InChI=1S/C21H23ClN4O4S2/c1-4-8-26-14-7-6-12(22)9-13(14)24-21(26)31-10-15(27)25-19-16(20(29)30-5-2)11(3)17(32-19)18(23)28/h6-7,9H,4-5,8,10H2,1-3H3,(H2,23,28)(H,25,27)