1-(3-fluoranyl-4-methyl-phenyl)-3-[(3-nitrophenyl)carbonylamino]thiourea

Systemtic Name: 1-(3-fluoranyl-4-methyl-phenyl)-3-[(3-nitrophenyl)carbonylamino]thiourea Openeye Name: 1-(3-fluoro-4-methyl-phenyl)-3-[(3-nitrobenzoyl)amino]thiourea CAS Name: 1-(3-fluoro-4-methylphenyl)-3-[[(3-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3-fluoro-4-methylphenyl)-3-[(3-nitrobenzoyl)amino]thiourea Traditional Name: 1-(3-fluoro-4-methyl-phenyl)-3-[(3-nitrobenzoyl)amino]thiourea Formula: C15H13FN4O3S MolecularWeight: 348.352123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13FN4O3S/c1-9-5-6-11(8-13(9)16)17-15(24)19-18-14(21)10-3-2-4-12(7-10)20(22)23/h2-8H,1H3,(H,18,21)(H2,17,19,24)