N-[3-(3-azanyl-4-methyl-phenyl)-1H-indazol-5-yl]-2-methylsulfonyl-benzenesulfonamide

Systemtic Name: N-[3-(3-azanyl-4-methyl-phenyl)-1H-indazol-5-yl]-2-methylsulfonyl-benzenesulfonamide Openeye Name: N-[3-(3-amino-4-methyl-phenyl)-1H-indazol-5-yl]-2-methylsulfonyl-benzenesulfonamide CAS Name: N-[3-(3-amino-4-methylphenyl)-1H-indazol-5-yl]-2-methylsulfonylbenzenesulfonamide IUPAC Name: N-[3-(3-amino-4-methylphenyl)-1H-indazol-5-yl]-2-methylsulfonylbenzenesulfonamide Traditional Name: N-[3-(3-amino-4-methyl-phenyl)-1H-indazol-5-yl]-2-mesyl-benzenesulfonamide Formula: C21H20N4O4S2 MolecularWeight: 456.5379

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC3=C2C=C(C=C3)NS(=O)(=O)C4=CC=CC=C4S(=O)(=O)C)N

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC3=C2C=C(C=C3)NS(=O)(=O)C4=CC=CC=C4S(=O)(=O)C)N

InChI

InChI=1S/C21H20N4O4S2/c1-13-7-8-14(11-17(13)22)21-16-12-15(9-10-18(16)23-24-21)25-31(28,29)20-6-4-3-5-19(20)30(2,26)27/h3-12,25H,22H2,1-2H3,(H,23,24)