N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide

Systemtic Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide Openeye Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide CAS Name: N-[2-[(3,4-dichlorophenyl)methylthio]ethyl]-4-(1-pyrrolidinylsulfonylmethyl)benzamide IUPAC Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide Traditional Name: N-[2-[(3,4-dichlorobenzyl)thio]ethyl]-4-(pyrrolidinosulfonylmethyl)benzamide Formula: C21H24Cl2N2O3S2 MolecularWeight: 487.46286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NCCSCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NCCSCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H24Cl2N2O3S2/c22-19-8-5-17(13-20(19)23)14-29-12-9-24-21(26)18-6-3-16(4-7-18)15-30(27,28)25-10-1-2-11-25/h3-8,13H,1-2,9-12,14-15H2,(H,24,26)