N-[(1R)-1-(1-adamantyl)ethyl]-3,5-dimethyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,5-dimethyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-1-benzyl-3,5-dimethyl-pyrazole-4-carboxamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,5-dimethyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-1-benzyl-3,5-dimethylpyrazole-4-carboxamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-1-benzyl-3,5-dimethyl-pyrazole-4-carboxamide Formula: C25H33N3O MolecularWeight: 391.54902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NC(C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)N[C@H](C)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H33N3O/c1-16-23(17(2)28(27-16)15-19-7-5-4-6-8-19)24(29)26-18(3)25-12-20-9-21(13-25)11-22(10-20)14-25/h4-8,18,20-22H,9-15H2,1-3H3,(H,26,29)/t18-,20?,21?,22?,25?/m1/s1