1-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]-3-methylsulfonyl-guanidine

Systemtic Name: 1-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]-3-methylsulfonyl-guanidine Openeye Name: 1-[2-(2-furylmethylsulfanyl)ethyl]-2-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-methylsulfonyl-guanidine CAS Name: 1-[2-(2-furanylmethylthio)ethyl]-2-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-methylsulfonylguanidine IUPAC Name: 1-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-methylsulfonylguanidine Traditional Name: 1-[2-(2-furfurylthio)ethyl]-2-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-mesyl-guanidine Formula: C17H23N3O5S2 MolecularWeight: 413.51162

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC(=NCC(C1=CC=C(C=C1)O)O)NCCSCC2=CC=CO2

Isomeric SMILES

CS(=O)(=O)NC(=NCC(C1=CC=C(C=C1)O)O)NCCSCC2=CC=CO2

InChI

InChI=1S/C17H23N3O5S2/c1-27(23,24)20-17(18-8-10-26-12-15-3-2-9-25-15)19-11-16(22)13-4-6-14(21)7-5-13/h2-7,9,16,21-22H,8,10-12H2,1H3,(H2,18,19,20)