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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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