1-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-3-methylsulfonyl-2-(2-oxidanyl-2-phenyl-ethyl)guanidine

Systemtic Name: 1-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-3-methylsulfonyl-2-(2-oxidanyl-2-phenyl-ethyl)guanidine Openeye Name: 1-[2-[[5-(dimethylaminomethyl)-2-furyl]methylsulfanyl]ethyl]-2-(2-hydroxy-2-phenyl-ethyl)-3-methylsulfonyl-guanidine CAS Name: 1-[2-[[5-(dimethylaminomethyl)-2-furanyl]methylthio]ethyl]-2-(2-hydroxy-2-phenylethyl)-3-methylsulfonylguanidine IUPAC Name: 1-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-2-(2-hydroxy-2-phenylethyl)-3-methylsulfonylguanidine Traditional Name: 1-[2-[[5-(dimethylaminomethyl)-2-furyl]methylthio]ethyl]-2-(2-hydroxy-2-phenyl-ethyl)-3-mesyl-guanidine Formula: C20H30N4O4S2 MolecularWeight: 454.6066

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(O1)CSCCNC(=NCC(C2=CC=CC=C2)O)NS(=O)(=O)C

Isomeric SMILES

CN(C)CC1=CC=C(O1)CSCCNC(=NCC(C2=CC=CC=C2)O)NS(=O)(=O)C

InChI

InChI=1S/C20H30N4O4S2/c1-24(2)14-17-9-10-18(28-17)15-29-12-11-21-20(23-30(3,26)27)22-13-19(25)16-7-5-4-6-8-16/h4-10,19,25H,11-15H2,1-3H3,(H2,21,22,23)