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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C[NH+]=CC=C2)S(=O)(=O)[N-]C3=CC=CC=C3C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C[NH+]=CC=C2)S(=O)(=O)[N-]C3=CC=CC=C3C

InChI

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