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

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(3-pyrazol-1-ylpropyl)propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-(3-pyrazol-1-ylpropyl)propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[3-(1-pyrazolyl)propyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-(3-pyrazol-1-ylpropyl)propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-(3-pyrazol-1-ylpropyl)propionamide Formula: C17H18BrN5O2 MolecularWeight: 404.26112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CCCNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

C1=CN(N=C1)CCCNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C17H18BrN5O2/c18-13-3-4-15-14(11-13)17(25)22(12-20-15)10-5-16(24)19-6-1-8-23-9-2-7-21-23/h2-4,7,9,11-12H,1,5-6,8,10H2,(H,19,24)