1-(phenylmethyl)-3-[[3-(trifluoromethyl)phenyl]carbamothioylamino]thiourea

Systemtic Name: 1-(phenylmethyl)-3-[[3-(trifluoromethyl)phenyl]carbamothioylamino]thiourea Openeye Name: 1-benzyl-3-[[3-(trifluoromethyl)phenyl]carbamothioylamino]thiourea CAS Name: 1-(phenylmethyl)-3-[[sulfanylidene-[3-(trifluoromethyl)anilino]methyl]amino]thiourea IUPAC Name: 1-benzyl-3-[[3-(trifluoromethyl)phenyl]carbamothioylamino]thiourea Traditional Name: 1-benzyl-3-[[3-(trifluoromethyl)phenyl]thiocarbamoylamino]thiourea Formula: C16H15F3N4S2 MolecularWeight: 384.44231

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC(=S)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NNC(=S)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C16H15F3N4S2/c17-16(18,19)12-7-4-8-13(9-12)21-15(25)23-22-14(24)20-10-11-5-2-1-3-6-11/h1-9H,10H2,(H2,20,22,24)(H2,21,23,25)