N4-(4-chloranyl-3-methyl-phenyl)-5-methyl-N2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidine-2,4-diamine

Systemtic Name: N4-(4-chloranyl-3-methyl-phenyl)-5-methyl-N2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidine-2,4-diamine Openeye Name: N4-(4-chloro-3-methyl-phenyl)-5-methyl-N2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidine-2,4-diamine CAS Name: N4-(4-chloro-3-methylphenyl)-5-methyl-N2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-(4-chloro-3-methylphenyl)-5-methyl-2-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidine-2,4-diamine Traditional Name: [4-(4-chloro-3-methyl-anilino)-5-methyl-pyrimidin-2-yl]-[4-(2-pyrrolidinoethoxy)phenyl]amine Formula: C24H28ClN5O MolecularWeight: 437.96502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC(=NC=C2C)NC3=CC=C(C=C3)OCCN4CCCC4)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC(=NC=C2C)NC3=CC=C(C=C3)OCCN4CCCC4)Cl

InChI

InChI=1S/C24H28ClN5O/c1-17-15-20(7-10-22(17)25)27-23-18(2)16-26-24(29-23)28-19-5-8-21(9-6-19)31-14-13-30-11-3-4-12-30/h5-10,15-16H,3-4,11-14H2,1-2H3,(H2,26,27,28,29)