3-[(4-bromophenyl)sulfonylamino]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-[(4-bromophenyl)sulfonylamino]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-[(4-bromophenyl)sulfonylamino]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[(4-bromophenyl)sulfonylamino]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-[(4-bromophenyl)sulfonylamino]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(brosylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propionamide Formula: C18H18BrN3O4S2 MolecularWeight: 484.38722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H18BrN3O4S2/c1-2-26-13-5-8-15-16(11-13)27-18(21-15)22-17(23)9-10-20-28(24,25)14-6-3-12(19)4-7-14/h3-8,11,20H,2,9-10H2,1H3,(H,21,22,23)