N2-(3-chloranyl-4-fluoranyl-phenyl)-N4-(4-ethylphenyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(3-chloranyl-4-fluoranyl-phenyl)-N4-(4-ethylphenyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine Openeye Name: N2-(3-chloro-4-fluoro-phenyl)-N4-(4-ethylphenyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine CAS Name: N2-(3-chloro-4-fluorophenyl)-N4-(4-ethylphenyl)-6-(1-pyrrolidinyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(3-chloro-4-fluorophenyl)-4-N-(4-ethylphenyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine Traditional Name: [4-(3-chloro-4-fluoro-anilino)-6-pyrrolidino-s-triazin-2-yl]-(4-ethylphenyl)amine Formula: C21H22ClFN6 MolecularWeight: 412.890983

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC(=NC(=N2)N3CCCC3)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC(=NC(=N2)N3CCCC3)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H22ClFN6/c1-2-14-5-7-15(8-6-14)24-19-26-20(25-16-9-10-18(23)17(22)13-16)28-21(27-19)29-11-3-4-12-29/h5-10,13H,2-4,11-12H2,1H3,(H2,24,25,26,27,28)