2-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-methyl-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 1,3-diketo-2-methyl-N-[2-(methylthio)-1,3-benzothiazol-6-yl]isoindoline-5-carboxamide Formula: C18H13N3O3S2 MolecularWeight: 383.44412

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SC

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SC

InChI

InChI=1S/C18H13N3O3S2/c1-21-16(23)11-5-3-9(7-12(11)17(21)24)15(22)19-10-4-6-13-14(8-10)26-18(20-13)25-2/h3-8H,1-2H3,(H,19,22)