(3-bromanyl-4-methoxy-phenyl)-[4-(cycloheptylamino)-6-[(1-ethylpyrrolidin-2-yl)methylamino]-1,3,5-triazin-2-yl]cyanamide

Systemtic Name: (3-bromanyl-4-methoxy-phenyl)-[4-(cycloheptylamino)-6-[(1-ethylpyrrolidin-2-yl)methylamino]-1,3,5-triazin-2-yl]cyanamide Openeye Name: (3-bromo-4-methoxy-phenyl)-[4-(cycloheptylamino)-6-[(1-ethylpyrrolidin-2-yl)methylamino]-1,3,5-triazin-2-yl]cyanamide CAS Name: (3-bromo-4-methoxyphenyl)-[4-(cycloheptylamino)-6-[(1-ethyl-2-pyrrolidinyl)methylamino]-1,3,5-triazin-2-yl]cyanamide IUPAC Name: (3-bromo-4-methoxyphenyl)-[4-(cycloheptylamino)-6-[(1-ethylpyrrolidin-2-yl)methylamino]-1,3,5-triazin-2-yl]cyanamide Traditional Name: (3-bromo-4-methoxy-phenyl)-[4-(cycloheptylamino)-6-[(1-ethylpyrrolidin-2-yl)methylamino]-s-triazin-2-yl]cyanamide Formula: C25H35BrN8O MolecularWeight: 543.5024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35BrN8O/c1-3-33-14-8-11-20(33)16-28-23-30-24(29-18-9-6-4-5-7-10-18)32-25(31-23)34(17-27)19-12-13-22(35-2)21(26)15-19/h12-13,15,18,20H,3-11,14,16H2,1-2H3,(H2,28,29,30,31,32)