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[2,4-bis(trifluoromethyl)phenyl]methyl carbamimidothioate

[2,4-bis(trifluoromethyl)phenyl]methyl carbamimidothioate

Systemtic Name:[2,4-bis(trifluoromethyl)phenyl]methyl carbamimidothioate
Openeye Name:2-[[2,4-bis(trifluoromethyl)phenyl]methyl]isothiourea
CAS Name:carbamimidothioic acid [2,4-bis(trifluoromethyl)phenyl]methyl ester
IUPAC Name:[2,4-bis(trifluoromethyl)phenyl]methyl carbamimidothioate
Traditional Name:2-[2,4-bis(trifluoromethyl)benzyl]isothiourea
Formula: C10H8F6N2S
MolecularWeight: 302.239339
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)CSC(=N)N


Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)CSC(=N)N


InChI

InChI=1S/C10H8F6N2S/c11-9(12,13)6-2-1-5(4-19-8(17)18)7(3-6)10(14,15)16/h1-3H,4H2,(H3,17,18)


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