ethyl 4-[2-[3-oxidanylidene-1-(thiophen-2-ylmethyl)piperazin-2-yl]ethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[3-oxidanylidene-1-(thiophen-2-ylmethyl)piperazin-2-yl]ethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[3-oxo-1-(2-thienylmethyl)piperazin-2-yl]acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[1-oxo-2-[3-oxo-1-(thiophen-2-ylmethyl)-2-piperazinyl]ethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-oxo-1-(thiophen-2-ylmethyl)piperazin-2-yl]acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[3-keto-1-(2-thenyl)piperazin-2-yl]acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C19H28N4O4S MolecularWeight: 408.51502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CC2C(=O)NCCN2CC3=CC=CS3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CC2C(=O)NCCN2CC3=CC=CS3

InChI

InChI=1S/C19H28N4O4S/c1-2-27-19(26)22-8-5-14(6-9-22)21-17(24)12-16-18(25)20-7-10-23(16)13-15-4-3-11-28-15/h3-4,11,14,16H,2,5-10,12-13H2,1H3,(H,20,25)(H,21,24)