2-[4-(1-adamantylcarbonylamino)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide

Systemtic Name: 2-[4-(1-adamantylcarbonylamino)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide Openeye Name: 2-[4-(adamantane-1-carbonylamino)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide CAS Name: 2-[4-[[1-adamantyl(oxo)methyl]amino]phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[4-(adamantane-1-carbonylamino)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide Traditional Name: 2-[4-(adamantane-1-carbonylamino)phenyl]-N-cyclohexyl-3H-benzimidazole-5-carboxamide Formula: C31H36N4O2 MolecularWeight: 496.64314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)NC(=O)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)NC(=O)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C31H36N4O2/c36-29(32-24-4-2-1-3-5-24)23-8-11-26-27(15-23)35-28(34-26)22-6-9-25(10-7-22)33-30(37)31-16-19-12-20(17-31)14-21(13-19)18-31/h6-11,15,19-21,24H,1-5,12-14,16-18H2,(H,32,36)(H,33,37)(H,34,35)