1-[(2,4-dinitrophenyl)amino]-3-(3-fluoranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-[(2,4-dinitrophenyl)amino]-3-(3-fluoranyl-4-methyl-phenyl)thiourea Openeye Name: 1-(2,4-dinitroanilino)-3-(3-fluoro-4-methyl-phenyl)thiourea CAS Name: 1-(2,4-dinitroanilino)-3-(3-fluoro-4-methylphenyl)thiourea IUPAC Name: 1-(2,4-dinitroanilino)-3-(3-fluoro-4-methylphenyl)thiourea Traditional Name: 1-(2,4-dinitroanilino)-3-(3-fluoro-4-methyl-phenyl)thiourea Formula: C14H12FN5O4S MolecularWeight: 365.339583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C14H12FN5O4S/c1-8-2-3-9(6-11(8)15)16-14(25)18-17-12-5-4-10(19(21)22)7-13(12)20(23)24/h2-7,17H,1H3,(H2,16,18,25)