N4-methyl-6-propyl-7-[2-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: N4-methyl-6-propyl-7-[2-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidine-2,4-diamine Openeye Name: N4-methyl-6-propyl-7-[2-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidine-2,4-diamine CAS Name: N4-methyl-6-propyl-7-[2-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 4-N-methyl-6-propyl-7-[2-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidine-2,4-diamine Traditional Name: [2-amino-6-propyl-7-[2-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidin-4-yl]-methyl-amine Formula: C18H18F3N5 MolecularWeight: 361.36423

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C2C(=C1)C(=NC(=N2)N)NC)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCCC1=C(N=C2C(=C1)C(=NC(=N2)N)NC)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C18H18F3N5/c1-3-6-10-9-12-15(23-2)25-17(22)26-16(12)24-14(10)11-7-4-5-8-13(11)18(19,20)21/h4-5,7-9H,3,6H2,1-2H3,(H3,22,23,24,25,26)