1-[4-[3-(trifluoromethyl)phenyl]butanoylamino]thiourea

Systemtic Name: 1-[4-[3-(trifluoromethyl)phenyl]butanoylamino]thiourea Openeye Name: [4-[3-(trifluoromethyl)phenyl]butanoylamino]thiourea CAS Name: [[1-oxo-4-[3-(trifluoromethyl)phenyl]butyl]amino]thiourea IUPAC Name: [4-[3-(trifluoromethyl)phenyl]butanoylamino]thiourea Traditional Name: [4-[3-(trifluoromethyl)phenyl]butanoylamino]thiourea Formula: C12H14F3N3OS MolecularWeight: 305.31927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CCCC(=O)NNC(=S)N

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CCCC(=O)NNC(=S)N

InChI

InChI=1S/C12H14F3N3OS/c13-12(14,15)9-5-1-3-8(7-9)4-2-6-10(19)17-18-11(16)20/h1,3,5,7H,2,4,6H2,(H,17,19)(H3,16,18,20)