N-[4-azanyl-6-(3-methyl-3,4-dihydropyrazol-2-yl)-1,3,5-triazin-2-yl]-4-chloranyl-5-methyl-2-sulfanyl-benzenesulfonamide

Systemtic Name: N-[4-azanyl-6-(3-methyl-3,4-dihydropyrazol-2-yl)-1,3,5-triazin-2-yl]-4-chloranyl-5-methyl-2-sulfanyl-benzenesulfonamide Openeye Name: N-[4-amino-6-(3-methyl-3,4-dihydropyrazol-2-yl)-1,3,5-triazin-2-yl]-4-chloro-5-methyl-2-sulfanyl-benzenesulfonamide CAS Name: N-[4-amino-6-(3-methyl-3,4-dihydropyrazol-2-yl)-1,3,5-triazin-2-yl]-4-chloro-2-mercapto-5-methylbenzenesulfonamide IUPAC Name: N-[4-amino-6-(3-methyl-3,4-dihydropyrazol-2-yl)-1,3,5-triazin-2-yl]-4-chloro-5-methyl-2-sulfanylbenzenesulfonamide Traditional Name: N-[4-amino-6-(5-methyl-2-pyrazolin-1-yl)-s-triazin-2-yl]-4-chloro-2-mercapto-5-methyl-benzenesulfonamide Formula: C14H16ClN7O2S2 MolecularWeight: 413.90554

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC=NN1C2=NC(=NC(=N2)NS(=O)(=O)C3=C(C=C(C(=C3)C)Cl)S)N

Isomeric SMILES

CC1CC=NN1C2=NC(=NC(=N2)NS(=O)(=O)C3=C(C=C(C(=C3)C)Cl)S)N

InChI

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