(2S)-4-(2-pyridin-3-ylquinazolin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-4-(2-pyridin-3-ylquinazolin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-[2-(3-pyridyl)quinazolin-4-yl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-[2-(3-pyridinyl)-4-quinazolinyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-(2-pyridin-3-ylquinazolin-4-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-[2-(3-pyridyl)quinazolin-4-yl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H17N5O2 MolecularWeight: 383.40268

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5)C(=O)N

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2N1C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5)C(=O)N

InChI

InChI=1S/C22H17N5O2/c23-20(28)19-13-27(17-9-3-4-10-18(17)29-19)22-15-7-1-2-8-16(15)25-21(26-22)14-6-5-11-24-12-14/h1-12,19H,13H2,(H2,23,28)/t19-/m0/s1