N-[[4-[[3-(1H-pyrazol-5-yl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[[3-(1H-pyrazol-5-yl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[[3-(1H-pyrazol-5-yl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[oxo-[3-(1H-pyrazol-5-yl)anilino]methyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[[3-(1H-pyrazol-5-yl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-[[3-(1H-pyrazol-5-yl)phenyl]carbamoyl]benzyl]adamantane-1-carboxamide Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(=O)NC5=CC=CC(=C5)C6=CC=NN6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(=O)NC5=CC=CC(=C5)C6=CC=NN6

InChI

InChI=1S/C28H30N4O2/c33-26(31-24-3-1-2-23(13-24)25-8-9-30-32-25)22-6-4-18(5-7-22)17-29-27(34)28-14-19-10-20(15-28)12-21(11-19)16-28/h1-9,13,19-21H,10-12,14-17H2,(H,29,34)(H,30,32)(H,31,33)