3-{[2,6-dinitro-4-(trifluoromethyl)phenyl]amino}-1-(4-fluorophenyl)thiourea

CAS: 454453-49-7

Formula: C14H9F4N5O4S

SMILES: [O-][N+](=O)C1=CC(=CC(=C1NNC(=S)NC1=CC=C(F)C=C1)[N+]([O-])=O)C(F)(F)F

IUPAC: 3-{[2,6-dinitro-4-(trifluoromethyl)phenyl]amino}-1-(4-fluorophenyl)thiourea

InChI: InChI=1S/C14H9F4N5O4S/c15-8-1-3-9(4-2-8)19-13(28)21-20-12-10(22(24)25)5-7(14(16,17)18)6-11(12)23(26)27/h1-6,20H,(H2,19,21,28)

Composition: C (40.10%), H (2.16%), F (18.12%), N (16.70%), O (15.26%), S (7.65%)

Molar Mass: 419.31

Atom Count: 37

Heavy Atom Count: 28