1-[(3-nitrophenyl)carbonylamino]-1-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(3-nitrophenyl)carbonylamino]-1-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[(3-nitrobenzoyl)amino]-1-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[[(3-nitrophenyl)-oxomethyl]amino]-1-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(3-nitrobenzoyl)amino]-1-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[(3-nitrobenzoyl)amino]-1-[2-(trifluoromethyl)phenyl]thiourea Formula: C15H11F3N4O3S MolecularWeight: 384.33305

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11F3N4O3S/c16-15(17,18)11-6-1-2-7-12(11)21(14(19)26)20-13(23)9-4-3-5-10(8-9)22(24)25/h1-8H,(H2,19,26)(H,20,23)