N2-[4-[3-(dimethylamino)propoxy]phenyl]-N4-(3-methylphenyl)pyrimidine-2,4-diamine

Systemtic Name: N2-[4-[3-(dimethylamino)propoxy]phenyl]-N4-(3-methylphenyl)pyrimidine-2,4-diamine Openeye Name: N2-[4-[3-(dimethylamino)propoxy]phenyl]-N4-(m-tolyl)pyrimidine-2,4-diamine CAS Name: N2-[4-[3-(dimethylamino)propoxy]phenyl]-N4-(3-methylphenyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-[4-[3-(dimethylamino)propoxy]phenyl]-4-N-(3-methylphenyl)pyrimidine-2,4-diamine Traditional Name: dimethyl-[3-[4-[[4-(m-toluidino)pyrimidin-2-yl]amino]phenoxy]propyl]amine Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=NC=C2)NC3=CC=C(C=C3)OCCCN(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=NC=C2)NC3=CC=C(C=C3)OCCCN(C)C

InChI

InChI=1S/C22H27N5O/c1-17-6-4-7-19(16-17)24-21-12-13-23-22(26-21)25-18-8-10-20(11-9-18)28-15-5-14-27(2)3/h4,6-13,16H,5,14-15H2,1-3H3,(H2,23,24,25,26)