5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-3,4-dihydro-2H-1,5-benzothiazepine

Systemtic Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-3,4-dihydro-2H-1,5-benzothiazepine Openeye Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-3,4-dihydro-2H-1,5-benzothiazepine CAS Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-3,4-dihydro-2H-1,5-benzothiazepine IUPAC Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-3,4-dihydro-2H-1,5-benzothiazepine Traditional Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-3,4-dihydro-2H-1,5-benzothiazepine Formula: C18H19NO4S2 MolecularWeight: 377.47776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C18H19NO4S2/c20-25(21,14-7-8-16-17(13-14)23-11-4-10-22-16)19-9-3-12-24-18-6-2-1-5-15(18)19/h1-2,5-8,13H,3-4,9-12H2