4-(2-ethoxyphenoxy)-5-(2-phenylethynyl)-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine

Systemtic Name: 4-(2-ethoxyphenoxy)-5-(2-phenylethynyl)-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine Openeye Name: 4-(2-ethoxyphenoxy)-5-(2-phenylethynyl)-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine CAS Name: 4-(2-ethoxyphenoxy)-5-(2-phenylethynyl)-N-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-2-pyrimidinamine IUPAC Name: 4-(2-ethoxyphenoxy)-5-(2-phenylethynyl)-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine Traditional Name: [4-(2-ethoxyphenoxy)-5-(2-phenylethynyl)pyrimidin-2-yl]-[4-(2-pyrrolidinoethoxy)phenyl]amine Formula: C32H32N4O3 MolecularWeight: 520.62148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OC2=NC(=NC=C2C#CC3=CC=CC=C3)NC4=CC=C(C=C4)OCCN5CCCC5

Isomeric SMILES

CCOC1=CC=CC=C1OC2=NC(=NC=C2C#CC3=CC=CC=C3)NC4=CC=C(C=C4)OCCN5CCCC5

InChI

InChI=1S/C32H32N4O3/c1-2-37-29-12-6-7-13-30(29)39-31-26(15-14-25-10-4-3-5-11-25)24-33-32(35-31)34-27-16-18-28(19-17-27)38-23-22-36-20-8-9-21-36/h3-7,10-13,16-19,24H,2,8-9,20-23H2,1H3,(H,33,34,35)