N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(cyclohexen-1-yl)-N-(2-furylmethyl)-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]acetamide CAS Name: N-(1-cyclohexenyl)-N-(2-furanylmethyl)-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(cyclohexen-1-yl)-N-(2-furfuryl)-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]acetamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)N(CC2=CC=CO2)C(=O)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

C1CCC(=CC1)N(CC2=CC=CO2)C(=O)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H27N3O4S2/c26-22(25(16-19-9-6-14-29-19)18-7-2-1-3-8-18)17-30-21-11-10-20(15-23-21)31(27,28)24-12-4-5-13-24/h6-7,9-11,14-15H,1-5,8,12-13,16-17H2