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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(3-methoxypropyl)-N-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(3-methoxypropyl)-N-methyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(3-methoxypropyl)-N-methyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(3-methoxypropyl)-N-methyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1,3-diketo-2-(3-methoxypropyl)-N-methyl-isoindoline-5-carboxamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCCOC

Isomeric SMILES

CN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCCOC

InChI

InChI=1S/C21H19N3O4S/c1-23(21-22-16-6-3-4-7-17(16)29-21)18(25)13-8-9-14-15(12-13)20(27)24(19(14)26)10-5-11-28-2/h3-4,6-9,12H,5,10-11H2,1-2H3