3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propionamide Formula: C20H16BrN5O2 MolecularWeight: 438.27734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br)C4=CC=NN4

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br)C4=CC=NN4

InChI

InChI=1S/C20H16BrN5O2/c21-14-4-5-18-16(11-14)20(28)26(12-22-18)9-7-19(27)24-15-3-1-2-13(10-15)17-6-8-23-25-17/h1-6,8,10-12H,7,9H2,(H,23,25)(H,24,27)