N4-(1-azanylbutan-2-yl)-N2-(4-chlorophenyl)-N4-ethyl-5-phenoxy-pyrimidine-2,4-diamine

Systemtic Name: N4-(1-azanylbutan-2-yl)-N2-(4-chlorophenyl)-N4-ethyl-5-phenoxy-pyrimidine-2,4-diamine Openeye Name: N4-[1-(aminomethyl)propyl]-N2-(4-chlorophenyl)-N4-ethyl-5-phenoxy-pyrimidine-2,4-diamine CAS Name: N4-(1-aminobutan-2-yl)-N2-(4-chlorophenyl)-N4-ethyl-5-phenoxypyrimidine-2,4-diamine IUPAC Name: 4-N-(1-aminobutan-2-yl)-2-N-(4-chlorophenyl)-4-N-ethyl-5-phenoxypyrimidine-2,4-diamine Traditional Name: 1-(aminomethyl)propyl-[2-(4-chloroanilino)-5-phenoxy-pyrimidin-4-yl]-ethyl-amine Formula: C22H26ClN5O MolecularWeight: 411.92774

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN)N(CC)C1=NC(=NC=C1OC2=CC=CC=C2)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(CN)N(CC)C1=NC(=NC=C1OC2=CC=CC=C2)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H26ClN5O/c1-3-18(14-24)28(4-2)21-20(29-19-8-6-5-7-9-19)15-25-22(27-21)26-17-12-10-16(23)11-13-17/h5-13,15,18H,3-4,14,24H2,1-2H3,(H,25,26,27)