ethyl 2-[2-[3-(phenylcarbamoyl)piperidin-1-yl]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[3-(phenylcarbamoyl)piperidin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[3-(phenylcarbamoyl)-1-piperidyl]acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[3-[anilino(oxo)methyl]-1-piperidinyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[3-(phenylcarbamoyl)piperidin-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-[3-(phenylcarbamoyl)piperidino]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)CN2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)CN2CCCC(C2)C(=O)NC3=CC=CC=C3

InChI

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