N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(5-chloranylthiophen-2-yl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(5-chloranylthiophen-2-yl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-[(5-chloro-2-thienyl)sulfonyl]pyrrolidine-2-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-[(5-chloro-2-thiophenyl)sulfonyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(5-chlorothiophen-2-yl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-[(5-chloro-2-thienyl)sulfonyl]pyrrolidine-2-carboxamide Formula: C22H18ClN3O3S3 MolecularWeight: 504.04462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(S2)Cl)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(S2)Cl)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H18ClN3O3S3/c23-19-11-12-20(31-19)32(28,29)26-13-3-5-17(26)21(27)24-15-9-7-14(8-10-15)22-25-16-4-1-2-6-18(16)30-22/h1-2,4,6-12,17H,3,5,13H2,(H,24,27)