1-[2-[3-(1H-imidazol-2-ylsulfanyl)propoxy]pyrimidin-4-yl]-2-[2,2,2-tris(fluoranyl)ethyl]guanidine

Systemtic Name: 1-[2-[3-(1H-imidazol-2-ylsulfanyl)propoxy]pyrimidin-4-yl]-2-[2,2,2-tris(fluoranyl)ethyl]guanidine Openeye Name: 1-[2-[3-(1H-imidazol-2-ylsulfanyl)propoxy]pyrimidin-4-yl]-2-(2,2,2-trifluoroethyl)guanidine CAS Name: 1-[2-[3-(1H-imidazol-2-ylthio)propoxy]-4-pyrimidinyl]-2-(2,2,2-trifluoroethyl)guanidine IUPAC Name: 1-[2-[3-(1H-imidazol-2-ylsulfanyl)propoxy]pyrimidin-4-yl]-2-(2,2,2-trifluoroethyl)guanidine Traditional Name: 1-[2-[3-(1H-imidazol-2-ylthio)propoxy]pyrimidin-4-yl]-2-(2,2,2-trifluoroethyl)guanidine Formula: C13H16F3N7OS MolecularWeight: 375.37265

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1NC(=NCC(F)(F)F)N)OCCCSC2=NC=CN2

Isomeric SMILES

C1=CN=C(N=C1NC(=NCC(F)(F)F)N)OCCCSC2=NC=CN2

InChI

InChI=1S/C13H16F3N7OS/c14-13(15,16)8-21-10(17)22-9-2-3-18-11(23-9)24-6-1-7-25-12-19-4-5-20-12/h2-5H,1,6-8H2,(H,19,20)(H3,17,18,21,22,23)