ethyl 5-[(2,4-dimethylphenyl)carbamoyl]-2-[2-(4-methoxypiperidin-1-ium-1-yl)ethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-[(2,4-dimethylphenyl)carbamoyl]-2-[2-(4-methoxypiperidin-1-ium-1-yl)ethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-[(2,4-dimethylphenyl)carbamoyl]-2-[[2-(4-methoxypiperidin-1-ium-1-yl)acetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[(2,4-dimethylanilino)-oxomethyl]-2-[[2-(4-methoxy-1-piperidin-1-iumyl)-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2,4-dimethylphenyl)carbamoyl]-2-[[2-(4-methoxypiperidin-1-ium-1-yl)acetyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-[(2,4-dimethylphenyl)carbamoyl]-2-[[2-(4-methoxypiperidin-1-ium-1-yl)acetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H34N3O5S+ MolecularWeight: 488.61956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C=C(C=C2)C)C)NC(=O)C[NH+]3CCC(CC3)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C=C(C=C2)C)C)NC(=O)C[NH+]3CCC(CC3)OC

InChI

InChI=1S/C25H33N3O5S/c1-6-33-25(31)21-17(4)22(23(30)26-19-8-7-15(2)13-16(19)3)34-24(21)27-20(29)14-28-11-9-18(32-5)10-12-28/h7-8,13,18H,6,9-12,14H2,1-5H3,(H,26,30)(H,27,29)/p+1