ethyl 2-[3-(cyclohexylcarbamoyl)-5-phenyl-pyrazol-1-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[3-(cyclohexylcarbamoyl)-5-phenyl-pyrazol-1-yl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[3-(cyclohexylcarbamoyl)-5-phenyl-pyrazol-1-yl]thiazole-4-carboxylate CAS Name: 2-[3-[(cyclohexylamino)-oxomethyl]-5-phenyl-1-pyrazolyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(cyclohexylcarbamoyl)-5-phenylpyrazol-1-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[3-(cyclohexylcarbamoyl)-5-phenyl-pyrazol-1-yl]thiazole-4-carboxylic acid ethyl ester Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)N2C(=CC(=N2)C(=O)NC3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)N2C(=CC(=N2)C(=O)NC3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S/c1-2-29-21(28)18-14-30-22(24-18)26-19(15-9-5-3-6-10-15)13-17(25-26)20(27)23-16-11-7-4-8-12-16/h3,5-6,9-10,13-14,16H,2,4,7-8,11-12H2,1H3,(H,23,27)