N-[1-(1-adamantyl)pyrazol-3-yl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[1-(1-adamantyl)pyrazol-3-yl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[1-(1-adamantyl)pyrazol-3-yl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[1-(1-adamantyl)-3-pyrazolyl]-5-methyl-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[1-(1-adamantyl)pyrazol-3-yl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[1-(1-adamantyl)pyrazol-3-yl]-5-methyl-1,3-diphenyl-pyrazole-4-carboxamide Formula: C30H31N5O MolecularWeight: 477.60004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=NN(C=C4)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=NN(C=C4)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C30H31N5O/c1-20-27(28(24-8-4-2-5-9-24)33-35(20)25-10-6-3-7-11-25)29(36)31-26-12-13-34(32-26)30-17-21-14-22(18-30)16-23(15-21)19-30/h2-13,21-23H,14-19H2,1H3,(H,31,32,36)