ethyl 2-[[1-(2-fluorophenyl)piperidin-4-yl]carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[[1-(2-fluorophenyl)piperidin-4-yl]carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[1-(2-fluorophenyl)piperidine-4-carbonyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[[1-(2-fluorophenyl)-4-piperidinyl]-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(2-fluorophenyl)piperidine-4-carbonyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[1-(2-fluorophenyl)isonipecotoyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C19H22FN3O3S MolecularWeight: 391.459683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)C3=CC=CC=C3F)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)C3=CC=CC=C3F)C

InChI

InChI=1S/C19H22FN3O3S/c1-3-26-18(25)16-12(2)21-19(27-16)22-17(24)13-8-10-23(11-9-13)15-7-5-4-6-14(15)20/h4-7,13H,3,8-11H2,1-2H3,(H,21,22,24)