2-[4-(1-adamantylcarbamoyl)phenyl]-N-(4-methoxyphenyl)-3H-benzimidazole-5-carboxamide

Systemtic Name: 2-[4-(1-adamantylcarbamoyl)phenyl]-N-(4-methoxyphenyl)-3H-benzimidazole-5-carboxamide Openeye Name: 2-[4-(1-adamantylcarbamoyl)phenyl]-N-(4-methoxyphenyl)-3H-benzimidazole-5-carboxamide CAS Name: 2-[4-[(1-adamantylamino)-oxomethyl]phenyl]-N-(4-methoxyphenyl)-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[4-(1-adamantylcarbamoyl)phenyl]-N-(4-methoxyphenyl)-3H-benzimidazole-5-carboxamide Traditional Name: 2-[4-(1-adamantylcarbamoyl)phenyl]-N-(4-methoxyphenyl)-3H-benzimidazole-5-carboxamide Formula: C32H32N4O3 MolecularWeight: 520.62148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)C(=O)NC56CC7CC(C5)CC(C7)C6

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)C(=O)NC56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C32H32N4O3/c1-39-26-9-7-25(8-10-26)33-30(37)24-6-11-27-28(15-24)35-29(34-27)22-2-4-23(5-3-22)31(38)36-32-16-19-12-20(17-32)14-21(13-19)18-32/h2-11,15,19-21H,12-14,16-18H2,1H3,(H,33,37)(H,34,35)(H,36,38)