1-tert-butyl-3-[[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]amino]thiourea

Systemtic Name: 1-tert-butyl-3-[[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]amino]thiourea Openeye Name: 1-tert-butyl-3-[[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]amino]thiourea CAS Name: 1-tert-butyl-3-[[(E)-1-oxo-3-[4-(trifluoromethyl)phenyl]prop-2-enyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]amino]thiourea Traditional Name: 1-tert-butyl-3-[[(E)-3-[4-(trifluoromethyl)phenyl]acryloyl]amino]thiourea Formula: C15H18F3N3OS MolecularWeight: 345.38313

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)C=CC1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)/C=C/C1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C15H18F3N3OS/c1-14(2,3)19-13(23)21-20-12(22)9-6-10-4-7-11(8-5-10)15(16,17)18/h4-9H,1-3H3,(H,20,22)(H2,19,21,23)/b9-6+