(3S)-1-(4,7-dimethylquinazolin-2-yl)-N-[(3-methoxyphenyl)methyl]-N-methyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4,7-dimethylquinazolin-2-yl)-N-[(3-methoxyphenyl)methyl]-N-methyl-piperidine-3-carboxamide Openeye Name: (3S)-1-(4,7-dimethylquinazolin-2-yl)-N-[(3-methoxyphenyl)methyl]-N-methyl-piperidine-3-carboxamide CAS Name: (3S)-1-(4,7-dimethyl-2-quinazolinyl)-N-[(3-methoxyphenyl)methyl]-N-methyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4,7-dimethylquinazolin-2-yl)-N-[(3-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide Traditional Name: (3S)-1-(4,7-dimethylquinazolin-2-yl)-N-m-anisyl-N-methyl-nipecotamide Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(C3)C(=O)N(C)CC4=CC(=CC=C4)OC)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCC[C@@H](C3)C(=O)N(C)CC4=CC(=CC=C4)OC)C

InChI

InChI=1S/C25H30N4O2/c1-17-10-11-22-18(2)26-25(27-23(22)13-17)29-12-6-8-20(16-29)24(30)28(3)15-19-7-5-9-21(14-19)31-4/h5,7,9-11,13-14,20H,6,8,12,15-16H2,1-4H3/t20-/m0/s1