1-[[2-(2-azanylethylamino)-6,7-dimethoxy-quinazolin-4-yl]amino]urea

Systemtic Name: 1-[[2-(2-azanylethylamino)-6,7-dimethoxy-quinazolin-4-yl]amino]urea Openeye Name: [[2-(2-aminoethylamino)-6,7-dimethoxy-quinazolin-4-yl]amino]urea CAS Name: [[2-(2-aminoethylamino)-6,7-dimethoxy-4-quinazolinyl]amino]urea IUPAC Name: [[2-(2-aminoethylamino)-6,7-dimethoxyquinazolin-4-yl]amino]urea Traditional Name: [[2-(2-aminoethylamino)-6,7-dimethoxy-quinazolin-4-yl]amino]urea Formula: C13H19N7O3 MolecularWeight: 321.33506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)NCCN)NNC(=O)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)NCCN)NNC(=O)N)OC

InChI

InChI=1S/C13H19N7O3/c1-22-9-5-7-8(6-10(9)23-2)17-13(16-4-3-14)18-11(7)19-20-12(15)21/h5-6H,3-4,14H2,1-2H3,(H3,15,20,21)(H2,16,17,18,19)