N-[2-[4-[(2-phenylcyclopropyl)carbonylamino]phenyl]-3H-benzimidazol-5-yl]adamantane-2-carboxamide

Systemtic Name: N-[2-[4-[(2-phenylcyclopropyl)carbonylamino]phenyl]-3H-benzimidazol-5-yl]adamantane-2-carboxamide Openeye Name: N-[2-[4-[(2-phenylcyclopropanecarbonyl)amino]phenyl]-3H-benzimidazol-5-yl]adamantane-2-carboxamide CAS Name: N-[2-[4-[[oxo-(2-phenylcyclopropyl)methyl]amino]phenyl]-3H-benzimidazol-5-yl]-2-adamantanecarboxamide IUPAC Name: N-[2-[4-[(2-phenylcyclopropanecarbonyl)amino]phenyl]-3H-benzimidazol-5-yl]adamantane-2-carboxamide Traditional Name: N-[2-[4-[(2-phenylcyclopropanecarbonyl)amino]phenyl]-3H-benzimidazol-5-yl]adamantane-2-carboxamide Formula: C34H34N4O2 MolecularWeight: 530.65936

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C(=O)NC4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)NC(=O)C7CC7C8=CC=CC=C8

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C(=O)NC4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)NC(=O)C7CC7C8=CC=CC=C8

InChI

InChI=1S/C34H34N4O2/c39-33(28-18-27(28)21-4-2-1-3-5-21)35-25-8-6-22(7-9-25)32-37-29-11-10-26(17-30(29)38-32)36-34(40)31-23-13-19-12-20(15-23)16-24(31)14-19/h1-11,17,19-20,23-24,27-28,31H,12-16,18H2,(H,35,39)(H,36,40)(H,37,38)