N-(2-cyclohexylsulfanylethyl)-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-cyclohexylsulfanylethyl)-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-cyclohexylsulfanylethyl)-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(cyclohexylthio)ethyl]-2-methoxy-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-cyclohexylsulfanylethyl)-2-methoxy-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(cyclohexylthio)ethyl]-2-methoxy-5-pyrrolidinosulfonyl-benzamide Formula: C20H30N2O4S2 MolecularWeight: 426.5932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCCSC3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCCSC3CCCCC3

InChI

InChI=1S/C20H30N2O4S2/c1-26-19-10-9-17(28(24,25)22-12-5-6-13-22)15-18(19)20(23)21-11-14-27-16-7-3-2-4-8-16/h9-10,15-16H,2-8,11-14H2,1H3,(H,21,23)