prop-2-ynyl 4-[4-[(3-fluoranyl-4-methyl-phenyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[4-[(3-fluoranyl-4-methyl-phenyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(3-fluoro-4-methyl-phenyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(3-fluoro-4-methylanilino)-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(3-fluoro-4-methylphenyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(3-fluoro-4-methyl-phenyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C20H20FN3O3S MolecularWeight: 401.454503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C)F

InChI

InChI=1S/C20H20FN3O3S/c1-3-10-27-20(26)24-8-6-14(7-9-24)19-23-17(12-28-19)18(25)22-15-5-4-13(2)16(21)11-15/h1,4-5,11-12,14H,6-10H2,2H3,(H,22,25)