1-[2,4-bis(fluoranyl)phenyl]-3-[(4-nitrophenyl)carbamothioylamino]thiourea

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-3-[(4-nitrophenyl)carbamothioylamino]thiourea Openeye Name: 1-(2,4-difluorophenyl)-3-[(4-nitrophenyl)carbamothioylamino]thiourea CAS Name: 1-[[(2,4-difluoroanilino)-sulfanylidenemethyl]amino]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-(2,4-difluorophenyl)-3-[(4-nitrophenyl)carbamothioylamino]thiourea Traditional Name: 1-(2,4-difluorophenyl)-3-[(4-nitrophenyl)thiocarbamoylamino]thiourea Formula: C14H11F2N5O2S2 MolecularWeight: 383.396246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NNC(=S)NC2=C(C=C(C=C2)F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NNC(=S)NC2=C(C=C(C=C2)F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H11F2N5O2S2/c15-8-1-6-12(11(16)7-8)18-14(25)20-19-13(24)17-9-2-4-10(5-3-9)21(22)23/h1-7H,(H2,17,19,24)(H2,18,20,25)