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

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-tert-butyl-thiourea Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-tert-butyl-thiourea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-tert-butylthiourea IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-tert-butylthiourea Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-tert-butyl-thiourea Formula: C13H14F6N2S MolecularWeight: 344.319079

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(C)(C)NC(=S)NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C13H14F6N2S/c1-11(2,3)21-10(22)20-9-5-7(12(14,15)16)4-8(6-9)13(17,18)19/h4-6H,1-3H3,(H2,20,21,22)