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

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Formula: C18H18ClN3O3S3 MolecularWeight: 456.00182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(S4)Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(S4)Cl)C

InChI

InChI=1S/C18H18ClN3O3S3/c1-10-5-6-13-16(11(10)2)20-18(26-13)21-17(23)12-4-3-9-22(12)28(24,25)15-8-7-14(19)27-15/h5-8,12H,3-4,9H2,1-2H3,(H,20,21,23)