N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-(3,4-dimethoxyphenyl)quinazoline-2,4-diamine

Systemtic Name: N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-(3,4-dimethoxyphenyl)quinazoline-2,4-diamine Openeye Name: N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-(3,4-dimethoxyphenyl)quinazoline-2,4-diamine CAS Name: N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N2-(3,4-dimethoxyphenyl)quinazoline-2,4-diamine IUPAC Name: 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-(3,4-dimethoxyphenyl)quinazoline-2,4-diamine Traditional Name: (5-cyclopropyl-1H-pyrazol-3-yl)-[2-(3,4-dimethoxyanilino)quinazolin-4-yl]amine Formula: C22H22N6O2 MolecularWeight: 402.44908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC3=CC=CC=C3C(=N2)NC4=NNC(=C4)C5CC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC3=CC=CC=C3C(=N2)NC4=NNC(=C4)C5CC5)OC

InChI

InChI=1S/C22H22N6O2/c1-29-18-10-9-14(11-19(18)30-2)23-22-24-16-6-4-3-5-15(16)21(26-22)25-20-12-17(27-28-20)13-7-8-13/h3-6,9-13H,7-8H2,1-2H3,(H3,23,24,25,26,27,28)