N-[3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]pyrazol-4-yl]cyclohexanecarboxamide

Systemtic Name: N-[3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]pyrazol-4-yl]cyclohexanecarboxamide Openeye Name: N-[3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]pyrazol-4-yl]cyclohexanecarboxamide CAS Name: N-[3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-4-pyrazolyl]cyclohexanecarboxamide IUPAC Name: N-[3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]pyrazol-4-yl]cyclohexanecarboxamide Traditional Name: N-[3,5-dimethyl-1-(3-phenoxybenzyl)pyrazol-4-yl]cyclohexanecarboxamide Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)OC3=CC=CC=C3)C)NC(=O)C4CCCCC4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)OC3=CC=CC=C3)C)NC(=O)C4CCCCC4

InChI

InChI=1S/C25H29N3O2/c1-18-24(26-25(29)21-11-5-3-6-12-21)19(2)28(27-18)17-20-10-9-15-23(16-20)30-22-13-7-4-8-14-22/h4,7-10,13-16,21H,3,5-6,11-12,17H2,1-2H3,(H,26,29)