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

Systemtic Name: 1-[[3,5-bis(trifluoromethyl)phenyl]carbonylamino]-3-methyl-thiourea Openeye Name: 1-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-methyl-thiourea CAS Name: 1-[[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]amino]-3-methylthiourea IUPAC Name: 1-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-methylthiourea Traditional Name: 1-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-methyl-thiourea Formula: C11H9F6N3OS MolecularWeight: 345.264079

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NNC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CNC(=S)NNC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C11H9F6N3OS/c1-18-9(22)20-19-8(21)5-2-6(10(12,13)14)4-7(3-5)11(15,16)17/h2-4H,1H3,(H,19,21)(H2,18,20,22)