(3S)-1-(4,7-dimethylquinazolin-2-yl)-N-(2-methylpropyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4,7-dimethylquinazolin-2-yl)-N-(2-methylpropyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(4,7-dimethylquinazolin-2-yl)-N-isobutyl-piperidine-3-carboxamide CAS Name: (3S)-1-(4,7-dimethyl-2-quinazolinyl)-N-(2-methylpropyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4,7-dimethylquinazolin-2-yl)-N-(2-methylpropyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(4,7-dimethylquinazolin-2-yl)-N-isobutyl-nipecotamide Formula: C20H28N4O MolecularWeight: 340.46252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(C3)C(=O)NCC(C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCC[C@@H](C3)C(=O)NCC(C)C)C

InChI

InChI=1S/C20H28N4O/c1-13(2)11-21-19(25)16-6-5-9-24(12-16)20-22-15(4)17-8-7-14(3)10-18(17)23-20/h7-8,10,13,16H,5-6,9,11-12H2,1-4H3,(H,21,25)/t16-/m0/s1