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

Systemtic Name: N4-(2-chlorophenyl)-5-methyl-N2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidine-2,4-diamine Openeye Name: N4-(2-chlorophenyl)-5-methyl-N2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidine-2,4-diamine CAS Name: N4-(2-chlorophenyl)-5-methyl-N2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-(2-chlorophenyl)-5-methyl-2-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidine-2,4-diamine Traditional Name: [4-(2-chloroanilino)-5-methyl-pyrimidin-2-yl]-[4-(2-pyrrolidinoethoxy)phenyl]amine Formula: C23H26ClN5O MolecularWeight: 423.93844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1NC2=CC=CC=C2Cl)NC3=CC=C(C=C3)OCCN4CCCC4

Isomeric SMILES

CC1=CN=C(N=C1NC2=CC=CC=C2Cl)NC3=CC=C(C=C3)OCCN4CCCC4

InChI

InChI=1S/C23H26ClN5O/c1-17-16-25-23(28-22(17)27-21-7-3-2-6-20(21)24)26-18-8-10-19(11-9-18)30-15-14-29-12-4-5-13-29/h2-3,6-11,16H,4-5,12-15H2,1H3,(H2,25,26,27,28)