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

Systemtic Name: ethyl 2-[[2-[1-(5-methyl-1-phenyl-pyrazol-4-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: ethyl 2-[[2-[1-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]-2-phenyl-acetate CAS Name: 2-[[[2-[1-[(5-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]-4-piperidinyl]-4-thiazolyl]-oxomethyl]amino]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carbonyl]amino]-2-phenylacetate Traditional Name: 2-[[2-[1-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]-2-phenyl-acetic acid ethyl ester Formula: C30H31N5O4S MolecularWeight: 557.66324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N(N=C4)C5=CC=CC=C5)C

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N(N=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C30H31N5O4S/c1-3-39-30(38)26(21-10-6-4-7-11-21)33-27(36)25-19-40-28(32-25)22-14-16-34(17-15-22)29(37)24-18-31-35(20(24)2)23-12-8-5-9-13-23/h4-13,18-19,22,26H,3,14-17H2,1-2H3,(H,33,36)