2-(3,5-dimethylpyrazol-1-yl)-N-[(4-fluorophenyl)methyl]-N-[1-(pyridin-3-ylmethylcarbamoyl)cyclohexyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-fluorophenyl)methyl]-N-[1-(pyridin-3-ylmethylcarbamoyl)cyclohexyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-fluorophenyl)methyl]-N-[1-(3-pyridylmethylcarbamoyl)cyclohexyl]thiazole-4-carboxamide CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-N-[(4-fluorophenyl)methyl]-N-[1-[oxo-(3-pyridinylmethylamino)methyl]cyclohexyl]-4-thiazolecarboxamide IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)-N-[(4-fluorophenyl)methyl]-N-[1-(pyridin-3-ylmethylcarbamoyl)cyclohexyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-N-(4-fluorobenzyl)-N-[1-(3-pyridylmethylcarbamoyl)cyclohexyl]thiazole-4-carboxamide Formula: C29H31FN6O2S MolecularWeight: 546.658843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC(=CS2)C(=O)N(CC3=CC=C(C=C3)F)C4(CCCCC4)C(=O)NCC5=CN=CC=C5)C

Isomeric SMILES

CC1=CC(=NN1C2=NC(=CS2)C(=O)N(CC3=CC=C(C=C3)F)C4(CCCCC4)C(=O)NCC5=CN=CC=C5)C

InChI

InChI=1S/C29H31FN6O2S/c1-20-15-21(2)36(34-20)28-33-25(19-39-28)26(37)35(18-22-8-10-24(30)11-9-22)29(12-4-3-5-13-29)27(38)32-17-23-7-6-14-31-16-23/h6-11,14-16,19H,3-5,12-13,17-18H2,1-2H3,(H,32,38)