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

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1,3-diketo-2-(tetrahydrofurfuryl)isoindoline-5-carboxamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H19N3O4S/c26-20(23-11-19-24-17-5-1-2-6-18(17)30-19)13-7-8-15-16(10-13)22(28)25(21(15)27)12-14-4-3-9-29-14/h1-2,5-8,10,14H,3-4,9,11-12H2,(H,23,26)