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

Systemtic Name: N-(2-adamantyl)-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-(2-adamantyl)-2-[4-(3-pyridylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide CAS Name: N-(2-adamantyl)-2-[4-[oxo-(3-pyridinylamino)methyl]phenyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-(2-adamantyl)-2-[4-(pyridin-3-ylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-(2-adamantyl)-2-[4-(3-pyridylcarbamoyl)phenyl]-3H-benzimidazole-5-carboxamide Formula: C30H29N5O2 MolecularWeight: 491.58356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)C(=O)NC7=CN=CC=C7

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)C(=O)NC7=CN=CC=C7

InChI

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