4-[4-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylsulfonyl)phenyl]sulfonylmorpholine

Systemtic Name: 4-[4-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylsulfonyl)phenyl]sulfonylmorpholine Openeye Name: 4-[4-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylsulfonyl)phenyl]sulfonylmorpholine CAS Name: 4-[4-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylsulfonyl)phenyl]sulfonylmorpholine IUPAC Name: 4-[4-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylsulfonyl)phenyl]sulfonylmorpholine Traditional Name: 4-[4-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylsulfonyl)phenyl]sulfonylmorpholine Formula: C19H22N2O5S3 MolecularWeight: 454.58338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C19H22N2O5S3/c22-28(23,20-11-13-26-14-12-20)16-6-8-17(9-7-16)29(24,25)21-10-3-15-27-19-5-2-1-4-18(19)21/h1-2,4-9H,3,10-15H2