N-[[4-[(pyridin-3-ylcarbonylamino)carbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[(pyridin-3-ylcarbonylamino)carbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[(pyridine-3-carbonylamino)carbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[oxo-[[oxo(3-pyridinyl)methyl]hydrazo]methyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[(pyridine-3-carbonylamino)carbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-(nicotinamidocarbamoyl)benzyl]adamantane-1-carboxamide Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(=O)NNC(=O)C5=CN=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(=O)NNC(=O)C5=CN=CC=C5

InChI

InChI=1S/C25H28N4O3/c30-22(28-29-23(31)21-2-1-7-26-15-21)20-5-3-16(4-6-20)14-27-24(32)25-11-17-8-18(12-25)10-19(9-17)13-25/h1-7,15,17-19H,8-14H2,(H,27,32)(H,28,30)(H,29,31)