N2-(3-bromanyl-4-methoxy-phenyl)-N4-cycloheptyl-N6-[(1-ethylpyrrolidin-2-yl)methyl]-N2-methyl-1,3,5-triazine-2,4,6-triamine

Systemtic Name: N2-(3-bromanyl-4-methoxy-phenyl)-N4-cycloheptyl-N6-[(1-ethylpyrrolidin-2-yl)methyl]-N2-methyl-1,3,5-triazine-2,4,6-triamine Openeye Name: N2-(3-bromo-4-methoxy-phenyl)-N4-cycloheptyl-N6-[(1-ethylpyrrolidin-2-yl)methyl]-N2-methyl-1,3,5-triazine-2,4,6-triamine CAS Name: N2-(3-bromo-4-methoxyphenyl)-N4-cycloheptyl-N6-[(1-ethyl-2-pyrrolidinyl)methyl]-N2-methyl-1,3,5-triazine-2,4,6-triamine IUPAC Name: 2-N-(3-bromo-4-methoxyphenyl)-4-N-cycloheptyl-6-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-N-methyl-1,3,5-triazine-2,4,6-triamine Traditional Name: (3-bromo-4-methoxy-phenyl)-[4-(cycloheptylamino)-6-[(1-ethylpyrrolidin-2-yl)methylamino]-s-triazin-2-yl]-methyl-amine Formula: C25H38BrN7O MolecularWeight: 532.51952

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC2=NC(=NC(=N2)NC3CCCCCC3)N(C)C4=CC(=C(C=C4)OC)Br

Isomeric SMILES

CCN1CCCC1CNC2=NC(=NC(=N2)NC3CCCCCC3)N(C)C4=CC(=C(C=C4)OC)Br

InChI

InChI=1S/C25H38BrN7O/c1-4-33-15-9-12-20(33)17-27-23-29-24(28-18-10-7-5-6-8-11-18)31-25(30-23)32(2)19-13-14-22(34-3)21(26)16-19/h13-14,16,18,20H,4-12,15,17H2,1-3H3,(H2,27,28,29,30,31)