N-[2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]ethyl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]ethyl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-[(2,6-dichlorophenyl)methylthio]ethyl]-2-methoxy-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[(2,6-dichlorobenzyl)thio]ethyl]-2-methoxy-5-pyrrolidinosulfonyl-benzamide Formula: C21H24Cl2N2O4S2 MolecularWeight: 503.46226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCCSCC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCCSCC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C21H24Cl2N2O4S2/c1-29-20-8-7-15(31(27,28)25-10-2-3-11-25)13-16(20)21(26)24-9-12-30-14-17-18(22)5-4-6-19(17)23/h4-8,13H,2-3,9-12,14H2,1H3,(H,24,26)