1-(5-chloranylthiophen-2-yl)sulfonyl-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Formula: C18H18ClN3O3S3 MolecularWeight: 456.00182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(S4)Cl)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(S4)Cl)C

InChI

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