ethyl 4-[4-[3-(thiophen-3-ylcarbonylamino)propanoylamino]butanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[3-(thiophen-3-ylcarbonylamino)propanoylamino]butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[3-(thiophene-3-carbonylamino)propanoylamino]butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[1-oxo-4-[[1-oxo-3-[[oxo(3-thiophenyl)methyl]amino]propyl]amino]butyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[3-(thiophene-3-carbonylamino)propanoylamino]butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-[3-(3-thenoylamino)propanoylamino]butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C20H30N4O5S MolecularWeight: 438.541

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)CCNC(=O)C2=CSC=C2

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)CCNC(=O)C2=CSC=C2

InChI

InChI=1S/C20H30N4O5S/c1-2-29-20(28)24-11-6-16(7-12-24)23-18(26)4-3-9-21-17(25)5-10-22-19(27)15-8-13-30-14-15/h8,13-14,16H,2-7,9-12H2,1H3,(H,21,25)(H,22,27)(H,23,26)