ethyl 4-(4-methylphenyl)-2-[2-(3-methylpiperidin-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-methylphenyl)-2-[2-(3-methylpiperidin-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3-methyl-1-piperidyl)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-[[2-(3-methyl-1-piperidinyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methylphenyl)-2-[[2-(3-methylpiperidin-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(3-methylpiperidino)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)CN3CCCC(C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)CN3CCCC(C3)C

InChI

InChI=1S/C22H28N2O3S/c1-4-27-22(26)20-18(17-9-7-15(2)8-10-17)14-28-21(20)23-19(25)13-24-11-5-6-16(3)12-24/h7-10,14,16H,4-6,11-13H2,1-3H3,(H,23,25)