1-tert-butyl-3-[3-(4-chloranyl-2-fluoranyl-phenyl)prop-2-enoylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[3-(4-chloranyl-2-fluoranyl-phenyl)prop-2-enoylamino]thiourea Openeye Name: 1-tert-butyl-3-[3-(4-chloro-2-fluoro-phenyl)prop-2-enoylamino]thiourea CAS Name: 1-tert-butyl-3-[[3-(4-chloro-2-fluorophenyl)-1-oxoprop-2-enyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[3-(4-chloro-2-fluorophenyl)prop-2-enoylamino]thiourea Traditional Name: 1-tert-butyl-3-[[3-(4-chloro-2-fluoro-phenyl)acryloyl]amino]thiourea Formula: C14H17ClFN3OS MolecularWeight: 329.820683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClFN3OS/c1-14(2,3)17-13(21)19-18-12(20)7-5-9-4-6-10(15)8-11(9)16/h4-8H,1-3H3,(H,18,20)(H2,17,19,21)