[2-(4-aminocarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: [2-(4-aminocarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: [2-(4-carbamoyl-1-piperidyl)-2-oxo-ethyl] 2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-methylanilino)-2-oxoethyl]thio]acetic acid [2-(4-carbamoyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-carbamoylpiperidin-1-yl)-2-oxoethyl] 2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(p-toluidino)ethyl]thio]acetic acid [2-(4-carbamoylpiperidino)-2-keto-ethyl] ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)OCC(=O)N2CCC(CC2)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)OCC(=O)N2CCC(CC2)C(=O)N

InChI

InChI=1S/C19H25N3O5S/c1-13-2-4-15(5-3-13)21-16(23)11-28-12-18(25)27-10-17(24)22-8-6-14(7-9-22)19(20)26/h2-5,14H,6-12H2,1H3,(H2,20,26)(H,21,23)