N3-methyl-N3-[(5-methyl-1,2-oxazol-3-yl)methyl]benzene-1,3-disulfonamide

Systemtic Name: N3-methyl-N3-[(5-methyl-1,2-oxazol-3-yl)methyl]benzene-1,3-disulfonamide Openeye Name: N3-methyl-N3-[(5-methylisoxazol-3-yl)methyl]benzene-1,3-disulfonamide CAS Name: N3-methyl-N3-[(5-methyl-3-isoxazolyl)methyl]benzene-1,3-disulfonamide IUPAC Name: 3-N-methyl-3-N-[(5-methyl-1,2-oxazol-3-yl)methyl]benzene-1,3-disulfonamide Traditional Name: N'-methyl-N'-[(5-methylisoxazol-3-yl)methyl]benzene-1,3-disulfonamide Formula: C12H15N3O5S2 MolecularWeight: 345.3946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN(C)S(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=NO1)CN(C)S(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N

InChI

InChI=1S/C12H15N3O5S2/c1-9-6-10(14-20-9)8-15(2)22(18,19)12-5-3-4-11(7-12)21(13,16)17/h3-7H,8H2,1-2H3,(H2,13,16,17)