3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-pyrrolidin-1-ylphenyl)propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(2-pyrrolidin-1-ylphenyl)propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-(2-pyrrolidin-1-ylphenyl)propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[2-(1-pyrrolidinyl)phenyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-(2-pyrrolidin-1-ylphenyl)propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-(2-pyrrolidinophenyl)propionamide Formula: C21H21BrN4O2 MolecularWeight: 441.32104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=CC=C2NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CCN(C1)C2=CC=CC=C2NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H21BrN4O2/c22-15-7-8-17-16(13-15)21(28)26(14-23-17)12-9-20(27)24-18-5-1-2-6-19(18)25-10-3-4-11-25/h1-2,5-8,13-14H,3-4,9-12H2,(H,24,27)