N-(2-adamantyl)-5-(3-methoxyphenyl)-1,4-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-(2-adamantyl)-5-(3-methoxyphenyl)-1,4-dimethyl-pyrazole-3-carboxamide Openeye Name: N-(2-adamantyl)-5-(3-methoxyphenyl)-1,4-dimethyl-pyrazole-3-carboxamide CAS Name: N-(2-adamantyl)-5-(3-methoxyphenyl)-1,4-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-5-(3-methoxyphenyl)-1,4-dimethylpyrazole-3-carboxamide Traditional Name: N-(2-adamantyl)-5-(3-methoxyphenyl)-1,4-dimethyl-pyrazole-3-carboxamide Formula: C23H29N3O2 MolecularWeight: 379.49526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C(=O)NC2C3CC4CC(C3)CC2C4)C)C5=CC(=CC=C5)OC

Isomeric SMILES

CC1=C(N(N=C1C(=O)NC2C3CC4CC(C3)CC2C4)C)C5=CC(=CC=C5)OC

InChI

InChI=1S/C23H29N3O2/c1-13-20(25-26(2)22(13)16-5-4-6-19(12-16)28-3)23(27)24-21-17-8-14-7-15(10-17)11-18(21)9-14/h4-6,12,14-15,17-18,21H,7-11H2,1-3H3,(H,24,27)