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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-2-(3-methoxypropyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carboxamide Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O4S/c1-3-24(22-23-17-7-4-5-8-18(17)30-22)19(26)14-9-10-15-16(13-14)21(28)25(20(15)27)11-6-12-29-2/h4-5,7-10,13H,3,6,11-12H2,1-2H3