N-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-1,3-thiazol-2-yl]quinoline-8-sulfonamide

Systemtic Name: N-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-1,3-thiazol-2-yl]quinoline-8-sulfonamide Openeye Name: N-[(5E)-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-thiazol-2-yl]quinoline-8-sulfonamide CAS Name: N-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thiazolyl]-8-quinolinesulfonamide IUPAC Name: N-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-1,3-thiazol-2-yl]quinoline-8-sulfonamide Traditional Name: N-[(5E)-4-keto-5-piperonylidene-2-thiazolin-2-yl]quinoline-8-sulfonamide Formula: C20H13N3O5S2 MolecularWeight: 439.46432

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N=C(S3)NS(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/3\C(=O)N=C(S3)NS(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C20H13N3O5S2/c24-19-16(10-12-6-7-14-15(9-12)28-11-27-14)29-20(22-19)23-30(25,26)17-5-1-3-13-4-2-8-21-18(13)17/h1-10H,11H2,(H,22,23,24)/b16-10+