4-cyclopropyl-2-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-N-(5-oxidanyl-2-adamantyl)pyrimidine-5-carboxamide

Systemtic Name: 4-cyclopropyl-2-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-N-(5-oxidanyl-2-adamantyl)pyrimidine-5-carboxamide Openeye Name: 4-cyclopropyl-2-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyrimidine-5-carboxamide CAS Name: 4-cyclopropyl-2-[(3R,5S)-3,5-dimethyl-1-piperazinyl]-N-(5-hydroxy-2-adamantyl)-5-pyrimidinecarboxamide IUPAC Name: 4-cyclopropyl-2-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyrimidine-5-carboxamide Traditional Name: 4-cyclopropyl-2-[(3R,5S)-3,5-dimethylpiperazino]-N-(5-hydroxy-2-adamantyl)pyrimidine-5-carboxamide Formula: C24H35N5O2 MolecularWeight: 425.567

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=NC=C(C(=N2)C3CC3)C(=O)NC4C5CC6CC4CC(C6)(C5)O

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1)C)C2=NC=C(C(=N2)C3CC3)C(=O)NC4C5CC6CC4CC(C6)(C5)O

InChI

InChI=1S/C24H35N5O2/c1-13-11-29(12-14(2)26-13)23-25-10-19(21(28-23)16-3-4-16)22(30)27-20-17-5-15-6-18(20)9-24(31,7-15)8-17/h10,13-18,20,26,31H,3-9,11-12H2,1-2H3,(H,27,30)/t13-,14+,15?,17?,18?,20?,24?