3-cyano-N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]benzenesulfonamide

Systemtic Name: 3-cyano-N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]benzenesulfonamide Openeye Name: 3-cyano-N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]benzenesulfonamide CAS Name: 3-cyano-N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiazolyl]benzenesulfonamide IUPAC Name: 3-cyano-N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]benzenesulfonamide Traditional Name: 3-cyano-N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]benzenesulfonamide Formula: C18H13N3O4S2 MolecularWeight: 399.44352

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=CSC(=N3)NS(=O)(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=CSC(=N3)NS(=O)(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C18H13N3O4S2/c19-10-12-2-1-3-14(8-12)27(22,23)21-18-20-15(11-26-18)13-4-5-16-17(9-13)25-7-6-24-16/h1-5,8-9,11H,6-7H2,(H,20,21)