N-[2-[4-(cyclohexylcarbonylamino)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide

Systemtic Name: N-[2-[4-(cyclohexylcarbonylamino)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide Openeye Name: N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide CAS Name: N-[2-[4-[[cyclohexyl(oxo)methyl]amino]phenyl]-3H-benzimidazol-5-yl]-1-adamantanecarboxamide IUPAC Name: N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide Traditional Name: N-[2-[4-(cyclohexanecarbonylamino)phenyl]-3H-benzimidazol-5-yl]adamantane-1-carboxamide Formula: C31H36N4O2 MolecularWeight: 496.64314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)NC(=O)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)NC(=O)C56CC7CC(C5)CC(C7)C6

InChI

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