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

Systemtic Name: 5-[3-[2-butyl-4-(4-chlorophenyl)phenoxy]propoxy]-6-methyl-pyrimidine-2,4-diamine Openeye Name: 5-[3-[2-butyl-4-(4-chlorophenyl)phenoxy]propoxy]-6-methyl-pyrimidine-2,4-diamine CAS Name: 5-[3-[2-butyl-4-(4-chlorophenyl)phenoxy]propoxy]-6-methylpyrimidine-2,4-diamine IUPAC Name: 5-[3-[2-butyl-4-(4-chlorophenyl)phenoxy]propoxy]-6-methylpyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-[2-butyl-4-(4-chlorophenyl)phenoxy]propoxy]-6-methyl-pyrimidin-4-yl]amine Formula: C24H29ClN4O2 MolecularWeight: 440.96566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)C2=CC=C(C=C2)Cl)OCCCOC3=C(N=C(N=C3N)N)C

Isomeric SMILES

CCCCC1=C(C=CC(=C1)C2=CC=C(C=C2)Cl)OCCCOC3=C(N=C(N=C3N)N)C

InChI

InChI=1S/C24H29ClN4O2/c1-3-4-6-19-15-18(17-7-10-20(25)11-8-17)9-12-21(19)30-13-5-14-31-22-16(2)28-24(27)29-23(22)26/h7-12,15H,3-6,13-14H2,1-2H3,(H4,26,27,28,29)