(4-propan-2-ylphenyl)methyl N'-[2-(trifluoromethyl)phenyl]carbamimidothioate

Systemtic Name: (4-propan-2-ylphenyl)methyl N'-[2-(trifluoromethyl)phenyl]carbamimidothioate Openeye Name: 2-[(4-isopropylphenyl)methyl]-3-[2-(trifluoromethyl)phenyl]isothiourea CAS Name: N'-[2-(trifluoromethyl)phenyl]carbamimidothioic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl N'-[2-(trifluoromethyl)phenyl]carbamimidothioate Traditional Name: 2-(4-isopropylbenzyl)-3-[2-(trifluoromethyl)phenyl]isothiourea Formula: C18H19F3N2S MolecularWeight: 352.41707

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC(=NC2=CC=CC=C2C(F)(F)F)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC(=NC2=CC=CC=C2C(F)(F)F)N

InChI

InChI=1S/C18H19F3N2S/c1-12(2)14-9-7-13(8-10-14)11-24-17(22)23-16-6-4-3-5-15(16)18(19,20)21/h3-10,12H,11H2,1-2H3,(H2,22,23)