N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C21H20N4O5 MolecularWeight: 408.4073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)NCCCNC(=O)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)NCCCNC(=O)C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H20N4O5/c26-19(13-6-7-16-17(12-13)30-11-10-29-16)22-8-3-9-23-21(28)18-24-15-5-2-1-4-14(15)20(27)25-18/h1-2,4-7,12H,3,8-11H2,(H,22,26)(H,23,28)(H,24,25,27)