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

Systemtic Name: 2-chloranyl-N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[2-(diethylamino)-2-(3-thienyl)ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[2-(diethylamino)-2-(3-thiophenyl)ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[2-(diethylamino)-2-thiophen-3-ylethyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[2-(diethylamino)-2-(3-thienyl)ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C21H28ClN3O3S2 MolecularWeight: 470.04832

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Cl)C3=CSC=C3

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Cl)C3=CSC=C3

InChI

InChI=1S/C21H28ClN3O3S2/c1-3-24(4-2)20(16-9-12-29-15-16)14-23-21(26)18-13-17(7-8-19(18)22)30(27,28)25-10-5-6-11-25/h7-9,12-13,15,20H,3-6,10-11,14H2,1-2H3,(H,23,26)