2-bromanyl-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C19H24BrN3O3S2 MolecularWeight: 486.44616

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Br)C3=CSC=C3

Isomeric SMILES

CN(C)C(CNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Br)C3=CSC=C3

InChI

InChI=1S/C19H24BrN3O3S2/c1-22(2)18(14-7-10-27-13-14)12-21-19(24)16-11-15(5-6-17(16)20)28(25,26)23-8-3-4-9-23/h5-7,10-11,13,18H,3-4,8-9,12H2,1-2H3,(H,21,24)