ethyl 4-methyl-5-(methylcarbamoyl)-2-[2-[(4-methylphenyl)methylamino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[2-[(4-methylphenyl)methylamino]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[[2-(p-tolylmethylamino)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-methyl-5-(methylcarbamoyl)-2-[[2-[(4-methylphenyl)methylamino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[[2-[(4-methylphenyl)methylamino]acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-methyl-2-[[2-[(4-methylbenzyl)amino]acetyl]amino]-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)CNCC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)CNCC2=CC=C(C=C2)C

InChI

InChI=1S/C20H25N3O4S/c1-5-27-20(26)16-13(3)17(18(25)21-4)28-19(16)23-15(24)11-22-10-14-8-6-12(2)7-9-14/h6-9,22H,5,10-11H2,1-4H3,(H,21,25)(H,23,24)