4-[6-bromanyl-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-N-phenethyl-butanamide

Systemtic Name: 4-[6-bromanyl-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-N-phenethyl-butanamide Openeye Name: 4-(6-bromo-2,4-dioxo-1H-quinazolin-3-yl)-N-phenethyl-butanamide CAS Name: 4-(6-bromo-2,4-dioxo-1H-quinazolin-3-yl)-N-phenethylbutanamide IUPAC Name: 4-(6-bromo-2,4-dioxo-1H-quinazolin-3-yl)-N-phenethylbutanamide Traditional Name: 4-(6-bromo-2,4-diketo-1H-quinazolin-3-yl)-N-phenethyl-butyramide Formula: C20H20BrN3O3 MolecularWeight: 430.2951

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CCCN2C(=O)C3=C(C=CC(=C3)Br)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CCCN2C(=O)C3=C(C=CC(=C3)Br)NC2=O

InChI

InChI=1S/C20H20BrN3O3/c21-15-8-9-17-16(13-15)19(26)24(20(27)23-17)12-4-7-18(25)22-11-10-14-5-2-1-3-6-14/h1-3,5-6,8-9,13H,4,7,10-12H2,(H,22,25)(H,23,27)