N4-[4-(dimethylamino)cyclohexyl]-N2-[3-(ethylaminomethyl)-4-methoxy-phenyl]quinazoline-2,4-diamine

Systemtic Name: N4-[4-(dimethylamino)cyclohexyl]-N2-[3-(ethylaminomethyl)-4-methoxy-phenyl]quinazoline-2,4-diamine Openeye Name: N4-[4-(dimethylamino)cyclohexyl]-N2-[3-(ethylaminomethyl)-4-methoxy-phenyl]quinazoline-2,4-diamine CAS Name: N4-[4-(dimethylamino)cyclohexyl]-N2-[3-(ethylaminomethyl)-4-methoxyphenyl]quinazoline-2,4-diamine IUPAC Name: 4-N-[4-(dimethylamino)cyclohexyl]-2-N-[3-(ethylaminomethyl)-4-methoxyphenyl]quinazoline-2,4-diamine Traditional Name: [4-[[2-[3-(ethylaminomethyl)-4-methoxy-anilino]quinazolin-4-yl]amino]cyclohexyl]-dimethyl-amine Formula: C26H36N6O MolecularWeight: 448.60364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=C(C=CC(=C1)NC2=NC3=CC=CC=C3C(=N2)NC4CCC(CC4)N(C)C)OC

Isomeric SMILES

CCNCC1=C(C=CC(=C1)NC2=NC3=CC=CC=C3C(=N2)NC4CCC(CC4)N(C)C)OC

InChI

InChI=1S/C26H36N6O/c1-5-27-17-18-16-20(12-15-24(18)33-4)29-26-30-23-9-7-6-8-22(23)25(31-26)28-19-10-13-21(14-11-19)32(2)3/h6-9,12,15-16,19,21,27H,5,10-11,13-14,17H2,1-4H3,(H2,28,29,30,31)