N-[4-[5-(1-adamantylcarbonylamino)-1H-indol-2-yl]phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[5-(1-adamantylcarbonylamino)-1H-indol-2-yl]phenyl]adamantane-1-carboxamide Openeye Name: N-[4-[5-(adamantane-1-carbonylamino)-1H-indol-2-yl]phenyl]adamantane-1-carboxamide CAS Name: N-[4-[5-[[1-adamantyl(oxo)methyl]amino]-1H-indol-2-yl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[5-(adamantane-1-carbonylamino)-1H-indol-2-yl]phenyl]adamantane-1-carboxamide Traditional Name: N-[4-[5-(adamantane-1-carbonylamino)-1H-indol-2-yl]phenyl]adamantane-1-carboxamide Formula: C36H41N3O2 MolecularWeight: 547.72964

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)C5=CC6=C(N5)C=CC(=C6)NC(=O)C78CC9CC(C7)CC(C9)C8

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)C5=CC6=C(N5)C=CC(=C6)NC(=O)C78CC9CC(C7)CC(C9)C8

InChI

InChI=1S/C36H41N3O2/c40-33(35-15-21-7-22(16-35)9-23(8-21)17-35)37-29-3-1-27(2-4-29)32-14-28-13-30(5-6-31(28)39-32)38-34(41)36-18-24-10-25(19-36)12-26(11-24)20-36/h1-6,13-14,21-26,39H,7-12,15-20H2,(H,37,40)(H,38,41)