N-(1,3-benzodioxol-5-ylmethyl)-4-[6-bromanyl-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]butanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[6-bromanyl-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(6-bromo-2,4-dioxo-1H-quinazolin-3-yl)butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(6-bromo-2,4-dioxo-1H-quinazolin-3-yl)butanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(6-bromo-2,4-dioxo-1H-quinazolin-3-yl)butanamide Traditional Name: 4-(6-bromo-2,4-diketo-1H-quinazolin-3-yl)-N-piperonyl-butyramide Formula: C20H18BrN3O5 MolecularWeight: 460.27802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCCN3C(=O)C4=C(C=CC(=C4)Br)NC3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCCN3C(=O)C4=C(C=CC(=C4)Br)NC3=O

InChI

InChI=1S/C20H18BrN3O5/c21-13-4-5-15-14(9-13)19(26)24(20(27)23-15)7-1-2-18(25)22-10-12-3-6-16-17(8-12)29-11-28-16/h3-6,8-9H,1-2,7,10-11H2,(H,22,25)(H,23,27)