[2-(4-aminocarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate

Systemtic Name: [2-(4-aminocarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate Openeye Name: [2-(4-carbamoyl-1-piperidyl)-2-oxo-ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(3-fluorophenyl)-2-imidazolyl]thio]acetic acid [2-(4-carbamoyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-carbamoylpiperidin-1-yl)-2-oxoethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(3-fluorophenyl)imidazol-2-yl]thio]acetic acid [2-(4-carbamoylpiperidino)-2-keto-ethyl] ester Formula: C19H21FN4O4S MolecularWeight: 420.457843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)COC(=O)CSC2=NC=CN2C3=CC(=CC=C3)F

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)COC(=O)CSC2=NC=CN2C3=CC(=CC=C3)F

InChI

InChI=1S/C19H21FN4O4S/c20-14-2-1-3-15(10-14)24-9-6-22-19(24)29-12-17(26)28-11-16(25)23-7-4-13(5-8-23)18(21)27/h1-3,6,9-10,13H,4-5,7-8,11-12H2,(H2,21,27)