(2R)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: (2R)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Openeye Name: (2R)-1-[(5-bromo-2-thienyl)sulfonyl]-N-(4-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide CAS Name: (2R)-1-[(5-bromo-2-thiophenyl)sulfonyl]-N-(4-methyl-1,3-benzothiazol-2-yl)-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-(5-bromothiophen-2-yl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Traditional Name: (2R)-1-[(5-bromo-2-thienyl)sulfonyl]-N-(4-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Formula: C17H16BrN3O3S3 MolecularWeight: 486.42624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)[C@H]3CCCN3S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C17H16BrN3O3S3/c1-10-4-2-6-12-15(10)19-17(25-12)20-16(22)11-5-3-9-21(11)27(23,24)14-8-7-13(18)26-14/h2,4,6-8,11H,3,5,9H2,1H3,(H,19,20,22)/t11-/m1/s1