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

Systemtic Name: N2-cycloheptyl-N6-(3-fluoranyl-4-methoxy-phenyl)-N2-propyl-N4-(1-pyrrolidin-2-ylpropyl)-1,3,5-triazine-2,4,6-triamine Openeye Name: N2-cycloheptyl-N6-(3-fluoro-4-methoxy-phenyl)-N2-propyl-N4-(1-pyrrolidin-2-ylpropyl)-1,3,5-triazine-2,4,6-triamine CAS Name: N2-cycloheptyl-N6-(3-fluoro-4-methoxyphenyl)-N2-propyl-N4-[1-(2-pyrrolidinyl)propyl]-1,3,5-triazine-2,4,6-triamine IUPAC Name: 2-N-cycloheptyl-6-N-(3-fluoro-4-methoxyphenyl)-2-N-propyl-4-N-(1-pyrrolidin-2-ylpropyl)-1,3,5-triazine-2,4,6-triamine Traditional Name: cycloheptyl-[4-(3-fluoro-4-methoxy-anilino)-6-(1-pyrrolidin-2-ylpropylamino)-s-triazin-2-yl]-propyl-amine Formula: C27H42FN7O MolecularWeight: 499.667083

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCCCCC1)C2=NC(=NC(=N2)NC(CC)C3CCCN3)NC4=CC(=C(C=C4)OC)F

Isomeric SMILES

CCCN(C1CCCCCC1)C2=NC(=NC(=N2)NC(CC)C3CCCN3)NC4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C27H42FN7O/c1-4-17-35(20-11-8-6-7-9-12-20)27-33-25(30-19-14-15-24(36-3)21(28)18-19)32-26(34-27)31-22(5-2)23-13-10-16-29-23/h14-15,18,20,22-23,29H,4-13,16-17H2,1-3H3,(H2,30,31,32,33,34)