N6-cycloheptyl-N2-(3-fluoranyl-4-methoxy-phenyl)-N4-(1-pyrrolidin-2-ylethyl)-1,3,5-triazine-2,4,6-triamine

Systemtic Name: N6-cycloheptyl-N2-(3-fluoranyl-4-methoxy-phenyl)-N4-(1-pyrrolidin-2-ylethyl)-1,3,5-triazine-2,4,6-triamine Openeye Name: N6-cycloheptyl-N2-(3-fluoro-4-methoxy-phenyl)-N4-(1-pyrrolidin-2-ylethyl)-1,3,5-triazine-2,4,6-triamine CAS Name: N6-cycloheptyl-N2-(3-fluoro-4-methoxyphenyl)-N4-[1-(2-pyrrolidinyl)ethyl]-1,3,5-triazine-2,4,6-triamine IUPAC Name: 6-N-cycloheptyl-2-N-(3-fluoro-4-methoxyphenyl)-4-N-(1-pyrrolidin-2-ylethyl)-1,3,5-triazine-2,4,6-triamine Traditional Name: cycloheptyl-[4-(3-fluoro-4-methoxy-anilino)-6-(1-pyrrolidin-2-ylethylamino)-s-triazin-2-yl]amine Formula: C23H34FN7O MolecularWeight: 443.560763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCN1)NC2=NC(=NC(=N2)NC3CCCCCC3)NC4=CC(=C(C=C4)OC)F

Isomeric SMILES

CC(C1CCCN1)NC2=NC(=NC(=N2)NC3CCCCCC3)NC4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C23H34FN7O/c1-15(19-10-7-13-25-19)26-21-29-22(27-16-8-5-3-4-6-9-16)31-23(30-21)28-17-11-12-20(32-2)18(24)14-17/h11-12,14-16,19,25H,3-10,13H2,1-2H3,(H3,26,27,28,29,30,31)