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

Systemtic Name: N2-[3-(diethylaminomethyl)-4-methoxy-phenyl]-N4-[4-(dimethylamino)cyclohexyl]quinazoline-2,4-diamine Openeye Name: N2-[3-(diethylaminomethyl)-4-methoxy-phenyl]-N4-[4-(dimethylamino)cyclohexyl]quinazoline-2,4-diamine CAS Name: N2-[3-(diethylaminomethyl)-4-methoxyphenyl]-N4-[4-(dimethylamino)cyclohexyl]quinazoline-2,4-diamine IUPAC Name: 2-N-[3-(diethylaminomethyl)-4-methoxyphenyl]-4-N-[4-(dimethylamino)cyclohexyl]quinazoline-2,4-diamine Traditional Name: [4-[[2-[3-(diethylaminomethyl)-4-methoxy-anilino]quinazolin-4-yl]amino]cyclohexyl]-dimethyl-amine Formula: C28H40N6O MolecularWeight: 476.6568

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=CC(=C1)NC2=NC3=CC=CC=C3C(=N2)NC4CCC(CC4)N(C)C)OC

Isomeric SMILES

CCN(CC)CC1=C(C=CC(=C1)NC2=NC3=CC=CC=C3C(=N2)NC4CCC(CC4)N(C)C)OC

InChI

InChI=1S/C28H40N6O/c1-6-34(7-2)19-20-18-22(14-17-26(20)35-5)30-28-31-25-11-9-8-10-24(25)27(32-28)29-21-12-15-23(16-13-21)33(3)4/h8-11,14,17-18,21,23H,6-7,12-13,15-16,19H2,1-5H3,(H2,29,30,31,32)