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

Systemtic Name: ethyl 4-methyl-2-[(1-pyrimidin-2-ylpiperidin-4-yl)carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[(1-pyrimidin-2-ylpiperidine-4-carbonyl)amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[oxo-[1-(2-pyrimidinyl)-4-piperidinyl]methyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(1-pyrimidin-2-ylpiperidine-4-carbonyl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[1-(2-pyrimidyl)isonipecotoyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C17H21N5O3S MolecularWeight: 375.44534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)C3=NC=CC=N3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)C3=NC=CC=N3)C

InChI

InChI=1S/C17H21N5O3S/c1-3-25-15(24)13-11(2)20-17(26-13)21-14(23)12-5-9-22(10-6-12)16-18-7-4-8-19-16/h4,7-8,12H,3,5-6,9-10H2,1-2H3,(H,20,21,23)