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

Systemtic Name: N4-(1,3-benzodioxol-4-yl)-N2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-5-methyl-pyrimidine-2,4-diamine Openeye Name: N4-(1,3-benzodioxol-4-yl)-N2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-5-methyl-pyrimidine-2,4-diamine CAS Name: N4-(1,3-benzodioxol-4-yl)-N2-[3-methoxy-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-5-methylpyrimidine-2,4-diamine IUPAC Name: 4-N-(1,3-benzodioxol-4-yl)-2-N-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-5-methylpyrimidine-2,4-diamine Traditional Name: 1,3-benzodioxol-4-yl-[2-[3-methoxy-4-(2-pyrrolidinoethoxy)anilino]-5-methyl-pyrimidin-4-yl]amine Formula: C25H29N5O4 MolecularWeight: 463.52886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1NC2=C3C(=CC=C2)OCO3)NC4=CC(=C(C=C4)OCCN5CCCC5)OC

Isomeric SMILES

CC1=CN=C(N=C1NC2=C3C(=CC=C2)OCO3)NC4=CC(=C(C=C4)OCCN5CCCC5)OC

InChI

InChI=1S/C25H29N5O4/c1-17-15-26-25(29-24(17)28-19-6-5-7-21-23(19)34-16-33-21)27-18-8-9-20(22(14-18)31-2)32-13-12-30-10-3-4-11-30/h5-9,14-15H,3-4,10-13,16H2,1-2H3,(H2,26,27,28,29)