N-(1-adamantyl)-2-[4-(pyridin-3-ylcarbonylamino)phenyl]-3H-benzimidazole-5-carboxamide

Systemtic Name: N-(1-adamantyl)-2-[4-(pyridin-3-ylcarbonylamino)phenyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-(1-adamantyl)-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide CAS Name: N-(1-adamantyl)-2-[4-[[oxo(3-pyridinyl)methyl]amino]phenyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-(1-adamantyl)-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-(1-adamantyl)-2-(4-nicotinamidophenyl)-3H-benzimidazole-5-carboxamide Formula: C30H29N5O2 MolecularWeight: 491.58356

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)NC(=O)C7=CN=CC=C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)NC(=O)C7=CN=CC=C7

InChI

InChI=1S/C30H29N5O2/c36-28(23-2-1-9-31-17-23)32-24-6-3-21(4-7-24)27-33-25-8-5-22(13-26(25)34-27)29(37)35-30-14-18-10-19(15-30)12-20(11-18)16-30/h1-9,13,17-20H,10-12,14-16H2,(H,32,36)(H,33,34)(H,35,37)