3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[2-(phenylmethyl)pyrazol-3-yl]propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[2-(phenylmethyl)pyrazol-3-yl]propanamide Openeye Name: N-(2-benzylpyrazol-3-yl)-3-(6-bromo-4-oxo-quinazolin-3-yl)propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[2-(phenylmethyl)-3-pyrazolyl]propanamide IUPAC Name: N-(2-benzylpyrazol-3-yl)-3-(6-bromo-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-(2-benzylpyrazol-3-yl)-3-(6-bromo-4-keto-quinazolin-3-yl)propionamide Formula: C21H18BrN5O2 MolecularWeight: 452.30392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H18BrN5O2/c22-16-6-7-18-17(12-16)21(29)26(14-23-18)11-9-20(28)25-19-8-10-24-27(19)13-15-4-2-1-3-5-15/h1-8,10,12,14H,9,11,13H2,(H,25,28)