ethanedioic acid; ethyl 2-[2-(cyclohexylmethylamino)ethanoylamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethanedioic acid; ethyl 2-[2-(cyclohexylmethylamino)ethanoylamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(cyclohexylmethylamino)acetyl]amino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate; oxalic acid CAS Name: 2-[[2-(cyclohexylmethylamino)-1-oxoethyl]amino]-5-[diethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 2-[[2-(cyclohexylmethylamino)acetyl]amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate; oxalic acid Traditional Name: 2-[[2-(cyclohexylmethylamino)acetyl]amino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid ethyl ester; oxalic acid Formula: C24H37N3O8S MolecularWeight: 527.63088

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CNCC2CCCCC2)C(=O)OCC)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CNCC2CCCCC2)C(=O)OCC)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H35N3O4S.C2H2O4/c1-5-25(6-2)21(27)19-15(4)18(22(28)29-7-3)20(30-19)24-17(26)14-23-13-16-11-9-8-10-12-16;3-1(4)2(5)6/h16,23H,5-14H2,1-4H3,(H,24,26);(H,3,4)(H,5,6)