1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]urea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]urea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]urea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[4-[(2-methyl-6-propoxy-4-pyrimidinyl)amino]phenyl]urea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[4-[(2-methyl-6-propoxypyrimidin-4-yl)amino]phenyl]urea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]urea Formula: C23H25N5O4 MolecularWeight: 435.4757

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC(=NC(=C1)NC2=CC=C(C=C2)NC(=O)NC3=CC4=C(C=C3)OCCO4)C

Isomeric SMILES

CCCOC1=NC(=NC(=C1)NC2=CC=C(C=C2)NC(=O)NC3=CC4=C(C=C3)OCCO4)C

InChI

InChI=1S/C23H25N5O4/c1-3-10-32-22-14-21(24-15(2)25-22)26-16-4-6-17(7-5-16)27-23(29)28-18-8-9-19-20(13-18)31-12-11-30-19/h4-9,13-14H,3,10-12H2,1-2H3,(H,24,25,26)(H2,27,28,29)