7-chloranyl-N4-(2-diethylaminoethyl)-N2-[3-(diethylaminomethyl)-4-ethoxy-phenyl]quinazoline-2,4-diamine

Systemtic Name: 7-chloranyl-N4-(2-diethylaminoethyl)-N2-[3-(diethylaminomethyl)-4-ethoxy-phenyl]quinazoline-2,4-diamine Openeye Name: 7-chloro-N4-(2-diethylaminoethyl)-N2-[3-(diethylaminomethyl)-4-ethoxy-phenyl]quinazoline-2,4-diamine CAS Name: 7-chloro-N4-(2-diethylaminoethyl)-N2-[3-(diethylaminomethyl)-4-ethoxyphenyl]quinazoline-2,4-diamine IUPAC Name: 7-chloro-4-N-(2-diethylaminoethyl)-2-N-[3-(diethylaminomethyl)-4-ethoxyphenyl]quinazoline-2,4-diamine Traditional Name: [5-[[7-chloro-4-(2-diethylaminoethylamino)quinazolin-2-yl]amino]-2-ethoxy-benzyl]-diethyl-amine Formula: C27H39ClN6O MolecularWeight: 499.09116

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC(=NC2=C1C=CC(=C2)Cl)NC3=CC(=C(C=C3)OCC)CN(CC)CC

Isomeric SMILES

CCN(CC)CCNC1=NC(=NC2=C1C=CC(=C2)Cl)NC3=CC(=C(C=C3)OCC)CN(CC)CC

InChI

InChI=1S/C27H39ClN6O/c1-6-33(7-2)16-15-29-26-23-13-11-21(28)18-24(23)31-27(32-26)30-22-12-14-25(35-10-5)20(17-22)19-34(8-3)9-4/h11-14,17-18H,6-10,15-16,19H2,1-5H3,(H2,29,30,31,32)