2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: 2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Openeye Name: 2-[(1,3-dioxoisoindolin-2-yl)methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide CAS Name: 2-[(1,3-dioxo-2-isoindolyl)methylthio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide IUPAC Name: 2-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Traditional Name: N,N-dimethyl-2-(phthalimidomethylthio)-1,3-benzoxazole-5-sulfonamide Formula: C18H15N3O5S2 MolecularWeight: 417.4588

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C18H15N3O5S2/c1-20(2)28(24,25)11-7-8-15-14(9-11)19-18(26-15)27-10-21-16(22)12-5-3-4-6-13(12)17(21)23/h3-9H,10H2,1-2H3