N-(2-methyl-1,3-benzothiazol-6-yl)-5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-benzamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-5-morpholinosulfonyl-2-pyrrolidin-1-yl-benzamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylbenzamide Traditional Name: N-(2-methyl-1,3-benzothiazol-6-yl)-5-morpholinosulfonyl-2-pyrrolidino-benzamide Formula: C23H26N4O4S2 MolecularWeight: 486.60694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N5CCCC5

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N5CCCC5

InChI

InChI=1S/C23H26N4O4S2/c1-16-24-20-6-4-17(14-22(20)32-16)25-23(28)19-15-18(5-7-21(19)26-8-2-3-9-26)33(29,30)27-10-12-31-13-11-27/h4-7,14-15H,2-3,8-13H2,1H3,(H,25,28)