3-[5-methyl-3-[[3-oxidanylidene-7-(2-sulfamoylphenyl)-1,4-benzoxazin-4-yl]methyl]pyrazol-1-yl]benzenecarboximidamide

Systemtic Name: 3-[5-methyl-3-[[3-oxidanylidene-7-(2-sulfamoylphenyl)-1,4-benzoxazin-4-yl]methyl]pyrazol-1-yl]benzenecarboximidamide Openeye Name: 3-[5-methyl-3-[[3-oxo-7-(2-sulfamoylphenyl)-1,4-benzoxazin-4-yl]methyl]pyrazol-1-yl]benzamidine CAS Name: 3-[5-methyl-3-[[3-oxo-7-(2-sulfamoylphenyl)-1,4-benzoxazin-4-yl]methyl]-1-pyrazolyl]benzenecarboximidamide IUPAC Name: 3-[5-methyl-3-[[3-oxo-7-(2-sulfamoylphenyl)-1,4-benzoxazin-4-yl]methyl]pyrazol-1-yl]benzenecarboximidamide Traditional Name: 3-[3-[[3-keto-7-(2-sulfamoylphenyl)-1,4-benzoxazin-4-yl]methyl]-5-methyl-pyrazol-1-yl]benzamidine Formula: C26H24N6O4S MolecularWeight: 516.57156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC(=C2)C(=N)N)CN3C(=O)COC4=C3C=CC(=C4)C5=CC=CC=C5S(=O)(=O)N

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC(=C2)C(=N)N)CN3C(=O)COC4=C3C=CC(=C4)C5=CC=CC=C5S(=O)(=O)N

InChI

InChI=1S/C26H24N6O4S/c1-16-11-19(30-32(16)20-6-4-5-18(12-20)26(27)28)14-31-22-10-9-17(13-23(22)36-15-25(31)33)21-7-2-3-8-24(21)37(29,34)35/h2-13H,14-15H2,1H3,(H3,27,28)(H2,29,34,35)