N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-morpholinosulfonyl-benzamide CAS Name: N-[2-[(2,4-dichlorophenyl)methylthio]ethyl]-2-methoxy-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-2-methoxy-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-[(2,4-dichlorobenzyl)thio]ethyl]-2-methoxy-5-morpholinosulfonyl-benzamide Formula: C21H24Cl2N2O5S2 MolecularWeight: 519.46166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCCSCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCCSCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H24Cl2N2O5S2/c1-29-20-5-4-17(32(27,28)25-7-9-30-10-8-25)13-18(20)21(26)24-6-11-31-14-15-2-3-16(22)12-19(15)23/h2-5,12-13H,6-11,14H2,1H3,(H,24,26)