N-[4-[[2-(2-hydroxyethyl)-2H-1,5-benzothiazepin-5-yl]sulfonyl]phenyl]ethanamide

Systemtic Name: N-[4-[[2-(2-hydroxyethyl)-2H-1,5-benzothiazepin-5-yl]sulfonyl]phenyl]ethanamide Openeye Name: N-[4-[[2-(2-hydroxyethyl)-2H-1,5-benzothiazepin-5-yl]sulfonyl]phenyl]acetamide CAS Name: N-[4-[[2-(2-hydroxyethyl)-2H-1,5-benzothiazepin-5-yl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[[2-(2-hydroxyethyl)-2H-1,5-benzothiazepin-5-yl]sulfonyl]phenyl]acetamide Traditional Name: N-[4-[[2-(2-hydroxyethyl)-2H-1,5-benzothiazepin-5-yl]sulfonyl]phenyl]acetamide Formula: C19H20N2O4S2 MolecularWeight: 404.5031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2C=CC(SC3=CC=CC=C32)CCO

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2C=CC(SC3=CC=CC=C32)CCO

InChI

InChI=1S/C19H20N2O4S2/c1-14(23)20-15-6-8-17(9-7-15)27(24,25)21-12-10-16(11-13-22)26-19-5-3-2-4-18(19)21/h2-10,12,16,22H,11,13H2,1H3,(H,20,23)