N2-(3,5-dimethylphenyl)-N4-(3-fluorophenyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(3,5-dimethylphenyl)-N4-(3-fluorophenyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine Openeye Name: N2-(3,5-dimethylphenyl)-N4-(3-fluorophenyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine CAS Name: N2-(3,5-dimethylphenyl)-N4-(3-fluorophenyl)-6-(1-pyrrolidinyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(3,5-dimethylphenyl)-4-N-(3-fluorophenyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine Traditional Name: [4-(3,5-dimethylanilino)-6-pyrrolidino-s-triazin-2-yl]-(3-fluorophenyl)amine Formula: C21H23FN6 MolecularWeight: 378.445923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC(=NC(=N2)NC3=CC(=CC=C3)F)N4CCCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC(=NC(=N2)NC3=CC(=CC=C3)F)N4CCCC4)C

InChI

InChI=1S/C21H23FN6/c1-14-10-15(2)12-18(11-14)24-20-25-19(23-17-7-5-6-16(22)13-17)26-21(27-20)28-8-3-4-9-28/h5-7,10-13H,3-4,8-9H2,1-2H3,(H2,23,24,25,26,27)