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

Systemtic Name: 2-(3-methoxypropyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-(3-methoxypropyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-(3-methoxypropyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-(3-methoxypropyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 1,3-diketo-2-(3-methoxypropyl)-N-(6-methyl-1,3-benzothiazol-2-yl)isoindoline-5-carboxamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCCOC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCCOC

InChI

InChI=1S/C21H19N3O4S/c1-12-4-7-16-17(10-12)29-21(22-16)23-18(25)13-5-6-14-15(11-13)20(27)24(19(14)26)8-3-9-28-2/h4-7,10-11H,3,8-9H2,1-2H3,(H,22,23,25)