3-(1-adamantyl)-1-phenyl-N-[1-(4-pyrrol-1-ylphenyl)ethyl]pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-1-phenyl-N-[1-(4-pyrrol-1-ylphenyl)ethyl]pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-1-phenyl-N-[1-(4-pyrrol-1-ylphenyl)ethyl]pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-1-phenyl-N-[1-[4-(1-pyrrolyl)phenyl]ethyl]-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-1-phenyl-N-[1-(4-pyrrol-1-ylphenyl)ethyl]pyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-1-phenyl-N-[1-(4-pyrrol-1-ylphenyl)ethyl]pyrazole-4-carboxamide Formula: C32H34N4O MolecularWeight: 490.63856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CC=C2)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CC=C2)NC(=O)C3=CN(N=C3C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

InChI

InChI=1S/C32H34N4O/c1-22(26-9-11-27(12-10-26)35-13-5-6-14-35)33-31(37)29-21-36(28-7-3-2-4-8-28)34-30(29)32-18-23-15-24(19-32)17-25(16-23)20-32/h2-14,21-25H,15-20H2,1H3,(H,33,37)