methyl N'-[2,2,2-tris(fluoranyl)ethyl]carbamimidothioate

Systemtic Name: methyl N'-[2,2,2-tris(fluoranyl)ethyl]carbamimidothioate Openeye Name: 2-methyl-3-(2,2,2-trifluoroethyl)isothiourea CAS Name: N'-(2,2,2-trifluoroethyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(2,2,2-trifluoroethyl)carbamimidothioate Traditional Name: 2-methyl-3-(2,2,2-trifluoroethyl)isothiourea Formula: C4H7F3N2S MolecularWeight: 172.17199

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCC(F)(F)F)N

Isomeric SMILES

CSC(=NCC(F)(F)F)N

InChI

InChI=1S/C4H7F3N2S/c1-10-3(8)9-2-4(5,6)7/h2H2,1H3,(H2,8,9)