4-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-pyridin-3-yl-quinazoline

Systemtic Name: 4-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-pyridin-3-yl-quinazoline Openeye Name: 4-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-(3-pyridyl)quinazoline CAS Name: 4-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-2-(3-pyridinyl)quinazoline IUPAC Name: 4-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-pyridin-3-ylquinazoline Traditional Name: 4-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-2-(3-pyridyl)quinazoline Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)C5=CC6=C(C=C5)OCCCO6

Isomeric SMILES

C1C[C@@H](N(C1)C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)C5=CC6=C(C=C5)OCCCO6

InChI

InChI=1S/C26H24N4O2/c1-2-8-21-20(7-1)26(29-25(28-21)19-6-3-12-27-17-19)30-13-4-9-22(30)18-10-11-23-24(16-18)32-15-5-14-31-23/h1-3,6-8,10-12,16-17,22H,4-5,9,13-15H2/t22-/m1/s1