5-methyl-N4-(7-methyl-1H-indol-6-yl)-N2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidine-2,4-diamine

Systemtic Name: 5-methyl-N4-(7-methyl-1H-indol-6-yl)-N2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidine-2,4-diamine Openeye Name: 5-methyl-N4-(7-methyl-1H-indol-6-yl)-N2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidine-2,4-diamine CAS Name: 5-methyl-N4-(7-methyl-1H-indol-6-yl)-N2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]pyrimidine-2,4-diamine IUPAC Name: 5-methyl-4-N-(7-methyl-1H-indol-6-yl)-2-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidine-2,4-diamine Traditional Name: (7-methyl-1H-indol-6-yl)-[5-methyl-2-[4-(2-pyrrolidinoethoxy)anilino]pyrimidin-4-yl]amine Formula: C26H30N6O MolecularWeight: 442.556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1NC2=C(C3=C(C=C2)C=CN3)C)NC4=CC=C(C=C4)OCCN5CCCC5

Isomeric SMILES

CC1=CN=C(N=C1NC2=C(C3=C(C=C2)C=CN3)C)NC4=CC=C(C=C4)OCCN5CCCC5

InChI

InChI=1S/C26H30N6O/c1-18-17-28-26(31-25(18)30-23-10-5-20-11-12-27-24(20)19(23)2)29-21-6-8-22(9-7-21)33-16-15-32-13-3-4-14-32/h5-12,17,27H,3-4,13-16H2,1-2H3,(H2,28,29,30,31)