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

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]-2-keto-3-methyl-1,3-benzoxazole-6-sulfonamide Formula: C22H17N3O4S2 MolecularWeight: 451.51808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC5=C(C=C4)N(C(=O)O5)C

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC5=C(C=C4)N(C(=O)O5)C

InChI

InChI=1S/C22H17N3O4S2/c1-13-11-14(21-23-17-5-3-4-6-20(17)30-21)7-9-16(13)24-31(27,28)15-8-10-18-19(12-15)29-22(26)25(18)2/h3-12,24H,1-2H3