N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C17H12F2N2O4S MolecularWeight: 378.349986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(O4)(F)F)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(O4)(F)F)NC1=O

InChI

InChI=1S/C17H12F2N2O4S/c18-17(19)24-12-3-2-10(8-13(12)25-17)20-16(23)9-1-4-14-11(7-9)21-15(22)5-6-26-14/h1-4,7-8H,5-6H2,(H,20,23)(H,21,22)