N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-2-methoxy-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-methoxy-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-2-methoxy-5-pyrrolidinosulfonyl-benzamide Formula: C19H24N2O5S2 MolecularWeight: 424.53426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCCSCC3=CC=CO3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCCSCC3=CC=CO3

InChI

InChI=1S/C19H24N2O5S2/c1-25-18-7-6-16(28(23,24)21-9-2-3-10-21)13-17(18)19(22)20-8-12-27-14-15-5-4-11-26-15/h4-7,11,13H,2-3,8-10,12,14H2,1H3,(H,20,22)