ethyl 4-phenyl-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidin-4-yl]carbonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-phenyl-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidin-4-yl]carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-phenyl-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]amino]thiazole-5-carboxylate CAS Name: 2-[[oxo-[1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinyl]methyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenyl-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-phenyl-2-[[1-[(E)-3-phenylacryloyl]isonipecotoyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C27H27N3O4S MolecularWeight: 489.58598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O4S/c1-2-34-26(33)24-23(20-11-7-4-8-12-20)28-27(35-24)29-25(32)21-15-17-30(18-16-21)22(31)14-13-19-9-5-3-6-10-19/h3-14,21H,2,15-18H2,1H3,(H,28,29,32)/b14-13+