N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,1,3-benzoxadiazole-4-sulfonamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,1,3-benzoxadiazole-4-sulfonamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,1,3-benzoxadiazole-4-sulfonamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,1,3-benzoxadiazole-4-sulfonamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,1,3-benzoxadiazole-4-sulfonamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzofurazan-4-sulfonamide Formula: C20H14N4O3S2 MolecularWeight: 422.48016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC5=NON=C54

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC5=NON=C54

InChI

InChI=1S/C20H14N4O3S2/c1-12-5-10-15-17(11-12)28-20(21-15)13-6-8-14(9-7-13)24-29(25,26)18-4-2-3-16-19(18)23-27-22-16/h2-11,24H,1H3