2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-6-methyl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(4-amino-6-anilino-s-triazin-2-yl)methylthio]-6-methyl-4-(trifluoromethyl)nicotinonitrile Formula: C18H14F3N7S MolecularWeight: 417.41087

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C18H14F3N7S/c1-10-7-13(18(19,20)21)12(8-22)15(24-10)29-9-14-26-16(23)28-17(27-14)25-11-5-3-2-4-6-11/h2-7H,9H2,1H3,(H3,23,25,26,27,28)