(3-methylphenyl)-[2-methyl-5-(pyridin-1-ium-3-ylcarbamoyl)phenyl]sulfonyl-azanide

Systemtic Name: (3-methylphenyl)-[2-methyl-5-(pyridin-1-ium-3-ylcarbamoyl)phenyl]sulfonyl-azanide Openeye Name: [2-methyl-5-(pyridin-1-ium-3-ylcarbamoyl)phenyl]sulfonyl-(m-tolyl)azanide CAS Name: [2-methyl-5-[oxo-(3-pyridin-1-iumylamino)methyl]phenyl]sulfonyl-(3-methylphenyl)azanide IUPAC Name: (3-methylphenyl)-[2-methyl-5-(pyridin-1-ium-3-ylcarbamoyl)phenyl]sulfonylazanide Traditional Name: [2-methyl-5-(pyridin-1-ium-3-ylcarbamoyl)phenyl]sulfonyl-(m-tolyl)azanide Formula: C20H19N3O3S MolecularWeight: 381.44816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)[N-]S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=C[NH+]=CC=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)[N-]S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=C[NH+]=CC=C3)C

InChI

InChI=1S/C20H18N3O3S/c1-14-5-3-6-17(11-14)23-27(25,26)19-12-16(9-8-15(19)2)20(24)22-18-7-4-10-21-13-18/h3-13H,1-2H3,(H,22,24)/q-1/p+1