N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(4-keto-1H-quinazolin-2-yl)butyramide Formula: C21H21N3O4 MolecularWeight: 379.40914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H21N3O4/c1-13(14-9-10-17-18(11-14)28-12-27-17)22-20(25)8-4-7-19-23-16-6-3-2-5-15(16)21(26)24-19/h2-3,5-6,9-11,13H,4,7-8,12H2,1H3,(H,22,25)(H,23,24,26)