3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-pyrazol-1-ylpyridin-3-yl)propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-pyrazol-1-ylpyridin-3-yl)propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-(2-pyrazol-1-yl-3-pyridyl)propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[2-(1-pyrazolyl)-3-pyridinyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-(2-pyrazol-1-ylpyridin-3-yl)propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-(2-pyrazol-1-yl-3-pyridyl)propionamide Formula: C19H15BrN6O2 MolecularWeight: 439.2654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)N2C=CC=N2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1=CC(=C(N=C1)N2C=CC=N2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C19H15BrN6O2/c20-13-4-5-15-14(11-13)19(28)25(12-22-15)10-6-17(27)24-16-3-1-7-21-18(16)26-9-2-8-23-26/h1-5,7-9,11-12H,6,10H2,(H,24,27)