methyl 3-[[2-[1-(5-methyl-1-phenyl-pyrazol-4-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[2-[1-(5-methyl-1-phenyl-pyrazol-4-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[2-[1-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]benzoate CAS Name: 3-[[[2-[1-[(5-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]-4-piperidinyl]-4-thiazolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carbonyl]amino]benzoate Traditional Name: 3-[[2-[1-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]benzoic acid methyl ester Formula: C28H27N5O4S MolecularWeight: 529.61008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCC(CC3)C4=NC(=CS4)C(=O)NC5=CC=CC(=C5)C(=O)OC

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCC(CC3)C4=NC(=CS4)C(=O)NC5=CC=CC(=C5)C(=O)OC

InChI

InChI=1S/C28H27N5O4S/c1-18-23(16-29-33(18)22-9-4-3-5-10-22)27(35)32-13-11-19(12-14-32)26-31-24(17-38-26)25(34)30-21-8-6-7-20(15-21)28(36)37-2/h3-10,15-17,19H,11-14H2,1-2H3,(H,30,34)