6-(3-bromanyl-4-methoxy-phenoxy)-N4-cycloheptyl-N2-(1-pyrrolidin-2-ylpropyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-(3-bromanyl-4-methoxy-phenoxy)-N4-cycloheptyl-N2-(1-pyrrolidin-2-ylpropyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-(3-bromo-4-methoxy-phenoxy)-N4-cycloheptyl-N2-(1-pyrrolidin-2-ylpropyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-(3-bromo-4-methoxyphenoxy)-N4-cycloheptyl-N2-[1-(2-pyrrolidinyl)propyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(3-bromo-4-methoxyphenoxy)-4-N-cycloheptyl-2-N-(1-pyrrolidin-2-ylpropyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-(3-bromo-4-methoxy-phenoxy)-6-(cycloheptylamino)-s-triazin-2-yl]-(1-pyrrolidin-2-ylpropyl)amine Formula: C24H35BrN6O2 MolecularWeight: 519.4777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCCN1)NC2=NC(=NC(=N2)NC3CCCCCC3)OC4=CC(=C(C=C4)OC)Br

Isomeric SMILES

CCC(C1CCCN1)NC2=NC(=NC(=N2)NC3CCCCCC3)OC4=CC(=C(C=C4)OC)Br

InChI

InChI=1S/C24H35BrN6O2/c1-3-19(20-11-8-14-26-20)28-23-29-22(27-16-9-6-4-5-7-10-16)30-24(31-23)33-17-12-13-21(32-2)18(25)15-17/h12-13,15-16,19-20,26H,3-11,14H2,1-2H3,(H2,27,28,29,30,31)