N-[2-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]ethyl]benzamide

Systemtic Name: N-[2-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]ethyl]benzamide Openeye Name: N-[2-[3-(6-bromo-4-oxo-quinazolin-3-yl)propanoylamino]ethyl]benzamide CAS Name: N-[2-[[3-(6-bromo-4-oxo-3-quinazolinyl)-1-oxopropyl]amino]ethyl]benzamide IUPAC Name: N-[2-[3-(6-bromo-4-oxoquinazolin-3-yl)propanoylamino]ethyl]benzamide Traditional Name: N-[2-[3-(6-bromo-4-keto-quinazolin-3-yl)propanoylamino]ethyl]benzamide Formula: C20H19BrN4O3 MolecularWeight: 443.29386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCCNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCCNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C20H19BrN4O3/c21-15-6-7-17-16(12-15)20(28)25(13-24-17)11-8-18(26)22-9-10-23-19(27)14-4-2-1-3-5-14/h1-7,12-13H,8-11H2,(H,22,26)(H,23,27)