(12R,12aR)-12-pyridin-3-yl-3,4,12,12a-tetrahydro-2H-benzimidazolo[2,1-b]quinazolin-1-one

Systemtic Name: (12R,12aR)-12-pyridin-3-yl-3,4,12,12a-tetrahydro-2H-benzimidazolo[2,1-b]quinazolin-1-one Openeye Name: (12R,12aR)-12-(3-pyridyl)-3,4,12,12a-tetrahydro-2H-benzimidazolo[2,1-b]quinazolin-1-one CAS Name: (12R,12aR)-12-(3-pyridinyl)-3,4,12,12a-tetrahydro-2H-benzimidazolo[2,1-b]quinazolin-1-one IUPAC Name: (12R,12aR)-12-pyridin-3-yl-3,4,12,12a-tetrahydro-2H-benzimidazolo[2,1-b]quinazolin-1-one Traditional Name: (12R,12aR)-12-(3-pyridyl)-3,4,12,12a-tetrahydro-2H-benzimidazolo[2,1-b]quinazolin-1-one Formula: C19H16N4O MolecularWeight: 316.35654

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC3=NC4=CC=CC=C4N3C(C2C(=O)C1)C5=CN=CC=C5

Isomeric SMILES

C1CC2=NC3=NC4=CC=CC=C4N3[C@H]([C@H]2C(=O)C1)C5=CN=CC=C5

InChI

InChI=1S/C19H16N4O/c24-16-9-3-7-14-17(16)18(12-5-4-10-20-11-12)23-15-8-2-1-6-13(15)21-19(23)22-14/h1-2,4-6,8,10-11,17-18H,3,7,9H2/t17-,18+/m1/s1