N-[(E)-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]methylideneamino]adamantane-1-carboxamide

Systemtic Name: N-[(E)-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]methylideneamino]adamantane-1-carboxamide Openeye Name: N-[(E)-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]methyleneamino]adamantane-1-carboxamide CAS Name: N-[(E)-[1-phenyl-3-(4-phenylphenyl)-4-pyrazolyl]methylideneamino]-1-adamantanecarboxamide IUPAC Name: N-[(E)-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]methylideneamino]adamantane-1-carboxamide Traditional Name: N-[(E)-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]methyleneamino]adamantane-1-carboxamide Formula: C33H32N4O MolecularWeight: 500.63338

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NN=CC4=CN(N=C4C5=CC=C(C=C5)C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)N/N=C/C4=CN(N=C4C5=CC=C(C=C5)C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C33H32N4O/c38-32(33-18-23-15-24(19-33)17-25(16-23)20-33)35-34-21-29-22-37(30-9-5-2-6-10-30)36-31(29)28-13-11-27(12-14-28)26-7-3-1-4-8-26/h1-14,21-25H,15-20H2,(H,35,38)/b34-21+