1-(4-methylphenyl)-3-[[3-(trifluoromethyl)phenyl]carbamothioylamino]thiourea

Systemtic Name: 1-(4-methylphenyl)-3-[[3-(trifluoromethyl)phenyl]carbamothioylamino]thiourea Openeye Name: 1-(p-tolyl)-3-[[3-(trifluoromethyl)phenyl]carbamothioylamino]thiourea CAS Name: 1-[[(4-methylanilino)-sulfanylidenemethyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(4-methylphenyl)-3-[[3-(trifluoromethyl)phenyl]carbamothioylamino]thiourea Traditional Name: 1-(p-tolyl)-3-[[3-(trifluoromethyl)phenyl]thiocarbamoylamino]thiourea Formula: C16H15F3N4S2 MolecularWeight: 384.44231

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NNC(=S)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NNC(=S)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C16H15F3N4S2/c1-10-5-7-12(8-6-10)20-14(24)22-23-15(25)21-13-4-2-3-11(9-13)16(17,18)19/h2-9H,1H3,(H2,20,22,24)(H2,21,23,25)