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

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolecarboxamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(tetrahydrofurfuryl)isoindoline-5-carboxamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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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)CC5CCCO5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5CCCO5

InChI

InChI=1S/C22H19N3O4S/c1-12-4-7-17-18(9-12)30-22(23-17)24-19(26)13-5-6-15-16(10-13)21(28)25(20(15)27)11-14-3-2-8-29-14/h4-7,9-10,14H,2-3,8,11H2,1H3,(H,23,24,26)