5-methyl-N-(2-phenylsulfanylethyl)-4-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide

Systemtic Name: 5-methyl-N-(2-phenylsulfanylethyl)-4-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide Openeye Name: 5-methyl-N-(2-phenylsulfanylethyl)-4-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide CAS Name: 5-methyl-N-[2-(phenylthio)ethyl]-4-(1-pyrrolidinylsulfonyl)-2-furancarboxamide IUPAC Name: 5-methyl-N-(2-phenylsulfanylethyl)-4-pyrrolidin-1-ylsulfonylfuran-2-carboxamide Traditional Name: 5-methyl-N-[2-(phenylthio)ethyl]-4-pyrrolidinosulfonyl-2-furamide Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)NCCSC2=CC=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=C(O1)C(=O)NCCSC2=CC=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H22N2O4S2/c1-14-17(26(22,23)20-10-5-6-11-20)13-16(24-14)18(21)19-9-12-25-15-7-3-2-4-8-15/h2-4,7-8,13H,5-6,9-12H2,1H3,(H,19,21)