ethyl 2-[2-(4-aminocarbonylpiperidin-1-yl)propanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-aminocarbonylpiperidin-1-yl)propanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(4-carbamoyl-1-piperidyl)propanoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(4-carbamoyl-1-piperidinyl)-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-carbamoylpiperidin-1-yl)propanoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[2-(4-carbamoylpiperidino)propanoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)N3CCC(CC3)C(=O)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C22H27N3O4S/c1-3-29-22(28)17-13-18(15-7-5-4-6-8-15)30-21(17)24-20(27)14(2)25-11-9-16(10-12-25)19(23)26/h4-8,13-14,16H,3,9-12H2,1-2H3,(H2,23,26)(H,24,27)