2-[[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-4-chloranyl-N-cyano-5-methyl-benzenesulfonamide

Systemtic Name: 2-[[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-4-chloranyl-N-cyano-5-methyl-benzenesulfonamide Openeye Name: 2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-4-chloro-N-cyano-5-methyl-benzenesulfonamide CAS Name: 2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylthio]-4-chloro-N-cyano-5-methylbenzenesulfonamide IUPAC Name: 2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-4-chloro-N-cyano-5-methylbenzenesulfonamide Traditional Name: 2-[[4-amino-6-(dimethylamino)-s-triazin-2-yl]methylthio]-4-chloro-N-cyano-5-methyl-benzenesulfonamide Formula: C14H16ClN7O2S2 MolecularWeight: 413.90554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)SCC2=NC(=NC(=N2)N(C)C)N)S(=O)(=O)NC#N

Isomeric SMILES

CC1=CC(=C(C=C1Cl)SCC2=NC(=NC(=N2)N(C)C)N)S(=O)(=O)NC#N

InChI

InChI=1S/C14H16ClN7O2S2/c1-8-4-11(26(23,24)18-7-16)10(5-9(8)15)25-6-12-19-13(17)21-14(20-12)22(2)3/h4-5,18H,6H2,1-3H3,(H2,17,19,20,21)