1-[3,5-bis(trifluoromethyl)phenyl]-3-(diphenylmethyl)thiourea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(diphenylmethyl)thiourea Openeye Name: 1-benzhydryl-3-[3,5-bis(trifluoromethyl)phenyl]thiourea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(diphenylmethyl)thiourea IUPAC Name: 1-benzhydryl-3-[3,5-bis(trifluoromethyl)phenyl]thiourea Traditional Name: 1-benzhydryl-3-[3,5-bis(trifluoromethyl)phenyl]thiourea Formula: C22H16F6N2S MolecularWeight: 454.431259

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=S)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=S)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C22H16F6N2S/c23-21(24,25)16-11-17(22(26,27)28)13-18(12-16)29-20(31)30-19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,19H,(H2,29,30,31)