2-phenoxy-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 2-phenoxy-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 2-phenoxy-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 2-phenoxy-N-[6-(1-pyrrolidinylsulfonyl)-1,3-benzothiazol-2-yl]propanamide IUPAC Name: 2-phenoxy-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 2-phenoxy-N-(6-pyrrolidinosulfonyl-1,3-benzothiazol-2-yl)propionamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCCC3)OC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCCC3)OC4=CC=CC=C4

InChI

InChI=1S/C20H21N3O4S2/c1-14(27-15-7-3-2-4-8-15)19(24)22-20-21-17-10-9-16(13-18(17)28-20)29(25,26)23-11-5-6-12-23/h2-4,7-10,13-14H,5-6,11-12H2,1H3,(H,21,22,24)