ethyl 3-[2-[(3S)-3-aminocarbonylpiperidin-1-yl]ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-[(3S)-3-aminocarbonylpiperidin-1-yl]ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-[(3S)-3-carbamoyl-1-piperidyl]acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[(3S)-3-carbamoyl-1-piperidinyl]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[(3S)-3-carbamoylpiperidin-1-yl]acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-[(3S)-3-carbamoylpiperidino]acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN3CCCC(C3)C(=O)N

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN3CCC[C@@H](C3)C(=O)N

InChI

InChI=1S/C21H25N3O4S/c1-2-28-21(27)19-16(11-17(29-19)14-7-4-3-5-8-14)23-18(25)13-24-10-6-9-15(12-24)20(22)26/h3-5,7-8,11,15H,2,6,9-10,12-13H2,1H3,(H2,22,26)(H,23,25)/t15-/m0/s1