N-(2-ethoxyphenyl)-5-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(2-ethoxyphenyl)-5-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-(2-ethoxyphenyl)-5-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(2-ethoxyphenyl)-5-[2-[(2R)-1-methyl-2-piperidin-1-iumyl]ethylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(2-ethoxyphenyl)-5-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethylthio]-1,3,4-thiadiazol-2-yl]-o-phenetyl-amine Formula: C18H27N4OS2+ MolecularWeight: 379.56318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC2=NN=C(S2)SCCC3CCCC[NH+]3C

Isomeric SMILES

CCOC1=CC=CC=C1NC2=NN=C(S2)SCC[C@H]3CCCC[NH+]3C

InChI

InChI=1S/C18H26N4OS2/c1-3-23-16-10-5-4-9-15(16)19-17-20-21-18(25-17)24-13-11-14-8-6-7-12-22(14)2/h4-5,9-10,14H,3,6-8,11-13H2,1-2H3,(H,19,20)/p+1/t14-/m1/s1