3-[[4-(2-cyanoethylamino)-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile

Systemtic Name: 3-[[4-(2-cyanoethylamino)-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile Openeye Name: 3-[[4-(2-cyanoethylamino)-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile CAS Name: 3-[[4-(2-cyanoethylamino)-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile IUPAC Name: 3-[[4-(2-cyanoethylamino)-6-(trichloromethyl)-1,3,5-triazin-2-yl]amino]propanenitrile Traditional Name: 3-[[4-(2-cyanoethylamino)-6-(trichloromethyl)-s-triazin-2-yl]amino]propionitrile Formula: C10H10Cl3N7 MolecularWeight: 334.5923

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Descriptors Computed from Structure

Canonical SMILES:

C(CNC1=NC(=NC(=N1)C(Cl)(Cl)Cl)NCCC#N)C#N

Isomeric SMILES

C(CNC1=NC(=NC(=N1)C(Cl)(Cl)Cl)NCCC#N)C#N

InChI

InChI=1S/C10H10Cl3N7/c11-10(12,13)7-18-8(16-5-1-3-14)20-9(19-7)17-6-2-4-15/h1-2,5-6H2,(H2,16,17,18,19,20)