4-methoxy-N-(2-methyl-1,3-benzothiazol-6-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-methoxy-N-(2-methyl-1,3-benzothiazol-6-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-methoxy-N-(2-methyl-1,3-benzothiazol-6-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-methoxy-N-(2-methyl-1,3-benzothiazol-6-yl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-methoxy-N-(2-methyl-1,3-benzothiazol-6-yl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-methoxy-N-(2-methyl-1,3-benzothiazol-6-yl)-3-pyrrolidinosulfonyl-benzamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H21N3O4S2/c1-13-21-16-7-6-15(12-18(16)28-13)22-20(24)14-5-8-17(27-2)19(11-14)29(25,26)23-9-3-4-10-23/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,22,24)