N-(2-cyclohexylsulfanylethyl)-2-methoxy-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(2-cyclohexylsulfanylethyl)-2-methoxy-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(2-cyclohexylsulfanylethyl)-2-methoxy-5-morpholinosulfonyl-benzamide CAS Name: N-[2-(cyclohexylthio)ethyl]-2-methoxy-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(2-cyclohexylsulfanylethyl)-2-methoxy-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-(cyclohexylthio)ethyl]-2-methoxy-5-morpholinosulfonyl-benzamide Formula: C20H30N2O5S2 MolecularWeight: 442.5926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCCSC3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCCSC3CCCCC3

InChI

InChI=1S/C20H30N2O5S2/c1-26-19-8-7-17(29(24,25)22-10-12-27-13-11-22)15-18(19)20(23)21-9-14-28-16-5-3-2-4-6-16/h7-8,15-16H,2-6,9-14H2,1H3,(H,21,23)