N-(6-ethyl-1,3-benzothiazol-2-yl)-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolecarboxamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1,3-diketo-2-(tetrahydrofurfuryl)isoindoline-5-carboxamide Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5CCCO5

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5CCCO5

InChI

InChI=1S/C23H21N3O4S/c1-2-13-5-8-18-19(10-13)31-23(24-18)25-20(27)14-6-7-16-17(11-14)22(29)26(21(16)28)12-15-4-3-9-30-15/h5-8,10-11,15H,2-4,9,12H2,1H3,(H,24,25,27)