1-[6-[4-(1-methylimidazol-2-yl)butylsulfanyl]pyridin-2-yl]-2-[2,2,2-tris(fluoranyl)ethyl]guanidine

Systemtic Name: 1-[6-[4-(1-methylimidazol-2-yl)butylsulfanyl]pyridin-2-yl]-2-[2,2,2-tris(fluoranyl)ethyl]guanidine Openeye Name: 1-[6-[4-(1-methylimidazol-2-yl)butylsulfanyl]-2-pyridyl]-2-(2,2,2-trifluoroethyl)guanidine CAS Name: 1-[6-[4-(1-methyl-2-imidazolyl)butylthio]-2-pyridinyl]-2-(2,2,2-trifluoroethyl)guanidine IUPAC Name: 1-[6-[4-(1-methylimidazol-2-yl)butylsulfanyl]pyridin-2-yl]-2-(2,2,2-trifluoroethyl)guanidine Traditional Name: 1-[6-[4-(1-methylimidazol-2-yl)butylthio]-2-pyridyl]-2-(2,2,2-trifluoroethyl)guanidine Formula: C16H21F3N6S MolecularWeight: 386.43835

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CCCCSC2=CC=CC(=N2)NC(=NCC(F)(F)F)N

Isomeric SMILES

CN1C=CN=C1CCCCSC2=CC=CC(=N2)NC(=NCC(F)(F)F)N

InChI

InChI=1S/C16H21F3N6S/c1-25-9-8-21-13(25)6-2-3-10-26-14-7-4-5-12(23-14)24-15(20)22-11-16(17,18)19/h4-5,7-9H,2-3,6,10-11H2,1H3,(H3,20,22,23,24)