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

Systemtic Name: N6-(3-fluoranyl-4-methoxy-phenyl)-N2-heptan-4-yl-N4-(1-pyrrolidin-2-ylpropyl)-1,3,5-triazine-2,4,6-triamine Openeye Name: N6-(3-fluoro-4-methoxy-phenyl)-N2-(1-propylbutyl)-N4-(1-pyrrolidin-2-ylpropyl)-1,3,5-triazine-2,4,6-triamine CAS Name: N6-(3-fluoro-4-methoxyphenyl)-N2-heptan-4-yl-N4-[1-(2-pyrrolidinyl)propyl]-1,3,5-triazine-2,4,6-triamine IUPAC Name: 6-N-(3-fluoro-4-methoxyphenyl)-2-N-heptan-4-yl-4-N-(1-pyrrolidin-2-ylpropyl)-1,3,5-triazine-2,4,6-triamine Traditional Name: [4-(3-fluoro-4-methoxy-anilino)-6-(1-propylbutylamino)-s-triazin-2-yl]-(1-pyrrolidin-2-ylpropyl)amine Formula: C24H38FN7O MolecularWeight: 459.603223

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=NC(=NC(=N1)NC(CC)C2CCCN2)NC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCCC(CCC)NC1=NC(=NC(=N1)NC(CC)C2CCCN2)NC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C24H38FN7O/c1-5-9-16(10-6-2)27-22-30-23(28-17-12-13-21(33-4)18(25)15-17)32-24(31-22)29-19(7-3)20-11-8-14-26-20/h12-13,15-16,19-20,26H,5-11,14H2,1-4H3,(H3,27,28,29,30,31,32)