[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate Openeye Name: [2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate CAS Name: 5-methyl-4-propyl-2-thiophenecarboxylic acid [2-oxo-2-[4-(1-piperidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylanilino)ethyl] 5-methyl-4-propylthiophene-2-carboxylate Traditional Name: 5-methyl-4-propyl-thiophene-2-carboxylic acid [2-keto-2-(4-piperidinoanilino)ethyl] ester Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCCC3)C

Isomeric SMILES

CCCC1=C(SC(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCCC3)C

InChI

InChI=1S/C22H28N2O3S/c1-3-7-17-14-20(28-16(17)2)22(26)27-15-21(25)23-18-8-10-19(11-9-18)24-12-5-4-6-13-24/h8-11,14H,3-7,12-13,15H2,1-2H3,(H,23,25)