5-thiophen-2-ylsulfonyl-3,4-dihydro-2H-1,5-benzothiazepine

Systemtic Name: 5-thiophen-2-ylsulfonyl-3,4-dihydro-2H-1,5-benzothiazepine Openeye Name: 5-(2-thienylsulfonyl)-3,4-dihydro-2H-1,5-benzothiazepine CAS Name: 5-thiophen-2-ylsulfonyl-3,4-dihydro-2H-1,5-benzothiazepine IUPAC Name: 5-thiophen-2-ylsulfonyl-3,4-dihydro-2H-1,5-benzothiazepine Traditional Name: 5-(2-thienylsulfonyl)-3,4-dihydro-2H-1,5-benzothiazepine Formula: C13H13NO2S3 MolecularWeight: 311.44282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C13H13NO2S3/c15-19(16,13-7-3-9-18-13)14-8-4-10-17-12-6-2-1-5-11(12)14/h1-3,5-7,9H,4,8,10H2