N-(2,2-dimethyl-3-oxidanyl-propyl)-1-(4,6,7-trimethylquinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(2,2-dimethyl-3-oxidanyl-propyl)-1-(4,6,7-trimethylquinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-(3-hydroxy-2,2-dimethyl-propyl)-1-(4,6,7-trimethylquinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-(3-hydroxy-2,2-dimethylpropyl)-1-(4,6,7-trimethyl-2-quinazolinyl)-4-piperidinecarboxamide IUPAC Name: N-(3-hydroxy-2,2-dimethylpropyl)-1-(4,6,7-trimethylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: N-(3-hydroxy-2,2-dimethyl-propyl)-1-(4,6,7-trimethylquinazolin-2-yl)isonipecotamide Formula: C22H32N4O2 MolecularWeight: 384.51508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)C(=O)NCC(C)(C)CO)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)C(=O)NCC(C)(C)CO)C)C

InChI

InChI=1S/C22H32N4O2/c1-14-10-18-16(3)24-21(25-19(18)11-15(14)2)26-8-6-17(7-9-26)20(28)23-12-22(4,5)13-27/h10-11,17,27H,6-9,12-13H2,1-5H3,(H,23,28)