N-(6-bromanyl-1,3-benzothiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]pyrrolidine-2-carboxamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thiophenyl)sulfonyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-(5-chlorothiophen-2-yl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]pyrrolidine-2-carboxamide Formula: C16H13BrClN3O3S3 MolecularWeight: 506.84472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(S2)Cl)C(=O)NC3=NC4=C(S3)C=C(C=C4)Br

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(S2)Cl)C(=O)NC3=NC4=C(S3)C=C(C=C4)Br

InChI

InChI=1S/C16H13BrClN3O3S3/c17-9-3-4-10-12(8-9)25-16(19-10)20-15(22)11-2-1-7-21(11)27(23,24)14-6-5-13(18)26-14/h3-6,8,11H,1-2,7H2,(H,19,20,22)