N-[1-[[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]-1-oxidanylidene-propan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]-1-oxidanylidene-propan-2-yl]adamantane-1-carboxamide Openeye Name: N-[2-[[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]-1-methyl-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[1-[[(3,5-dimethoxyphenyl)-(1-methyl-2-imidazolyl)methyl]amino]-1-oxopropan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-[[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]-1-oxopropan-2-yl]adamantane-1-carboxamide Traditional Name: N-[2-[[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]-2-keto-1-methyl-ethyl]adamantane-1-carboxamide Formula: C27H36N4O4 MolecularWeight: 480.59914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C1=CC(=CC(=C1)OC)OC)C2=NC=CN2C)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C(=O)NC(C1=CC(=CC(=C1)OC)OC)C2=NC=CN2C)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H36N4O4/c1-16(29-26(33)27-13-17-7-18(14-27)9-19(8-17)15-27)25(32)30-23(24-28-5-6-31(24)2)20-10-21(34-3)12-22(11-20)35-4/h5-6,10-12,16-19,23H,7-9,13-15H2,1-4H3,(H,29,33)(H,30,32)