5-[3-[4-(4-chlorophenyl)-2-prop-2-enyl-phenoxy]propoxy]-6-methyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[3-[4-(4-chlorophenyl)-2-prop-2-enyl-phenoxy]propoxy]-6-methyl-pyrimidine-2,4-diamine Openeye Name: 5-[3-[2-allyl-4-(4-chlorophenyl)phenoxy]propoxy]-6-methyl-pyrimidine-2,4-diamine CAS Name: 5-[3-[4-(4-chlorophenyl)-2-prop-2-enylphenoxy]propoxy]-6-methylpyrimidine-2,4-diamine IUPAC Name: 5-[3-[4-(4-chlorophenyl)-2-prop-2-enylphenoxy]propoxy]-6-methylpyrimidine-2,4-diamine Traditional Name: [5-[3-[2-allyl-4-(4-chlorophenyl)phenoxy]propoxy]-2-amino-6-methyl-pyrimidin-4-yl]amine Formula: C23H25ClN4O2 MolecularWeight: 424.9232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N)N)OCCCOC2=C(C=C(C=C2)C3=CC=C(C=C3)Cl)CC=C

Isomeric SMILES

CC1=C(C(=NC(=N1)N)N)OCCCOC2=C(C=C(C=C2)C3=CC=C(C=C3)Cl)CC=C

InChI

InChI=1S/C23H25ClN4O2/c1-3-5-18-14-17(16-6-9-19(24)10-7-16)8-11-20(18)29-12-4-13-30-21-15(2)27-23(26)28-22(21)25/h3,6-11,14H,1,4-5,12-13H2,2H3,(H4,25,26,27,28)