ethyl 4-[2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[2-(4-chloroanilino)-2-oxo-ethyl]sulfanylacetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[[2-(4-chloroanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylacetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[[2-(4-chloroanilino)-2-keto-ethyl]thio]acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C18H24ClN3O4S MolecularWeight: 413.91886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CSCC(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CSCC(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H24ClN3O4S/c1-2-26-18(25)22-9-7-15(8-10-22)21-17(24)12-27-11-16(23)20-14-5-3-13(19)4-6-14/h3-6,15H,2,7-12H2,1H3,(H,20,23)(H,21,24)