N-[2-[(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)amino]ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[2-[(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)amino]ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[2-[(4-amino-6,7-dimethoxy-quinazolin-2-yl)amino]ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[2-[(4-amino-6,7-dimethoxy-2-quinazolinyl)amino]ethyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[2-[(4-amino-6,7-dimethoxyquinazolin-2-yl)amino]ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[2-[(4-amino-6,7-dimethoxy-quinazolin-2-yl)amino]ethyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C21H23N5O5 MolecularWeight: 425.43782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)NCCNC(=O)C3COC4=CC=CC=C4O3)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)NCCNC(=O)C3COC4=CC=CC=C4O3)N)OC

InChI

InChI=1S/C21H23N5O5/c1-28-16-9-12-13(10-17(16)29-2)25-21(26-19(12)22)24-8-7-23-20(27)18-11-30-14-5-3-4-6-15(14)31-18/h3-6,9-10,18H,7-8,11H2,1-2H3,(H,23,27)(H3,22,24,25,26)