1-(4-fluorophenyl)-3-[3-(4-nitropyrazol-1-yl)propanoylamino]thiourea

Systemtic Name: 1-(4-fluorophenyl)-3-[3-(4-nitropyrazol-1-yl)propanoylamino]thiourea Openeye Name: 1-(4-fluorophenyl)-3-[3-(4-nitropyrazol-1-yl)propanoylamino]thiourea CAS Name: 1-(4-fluorophenyl)-3-[[3-(4-nitro-1-pyrazolyl)-1-oxopropyl]amino]thiourea IUPAC Name: 1-(4-fluorophenyl)-3-[3-(4-nitropyrazol-1-yl)propanoylamino]thiourea Traditional Name: 1-(4-fluorophenyl)-3-[3-(4-nitropyrazol-1-yl)propanoylamino]thiourea Formula: C13H13FN6O3S MolecularWeight: 352.344123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NNC(=O)CCN2C=C(C=N2)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NNC(=O)CCN2C=C(C=N2)[N+](=O)[O-])F

InChI

InChI=1S/C13H13FN6O3S/c14-9-1-3-10(4-2-9)16-13(24)18-17-12(21)5-6-19-8-11(7-15-19)20(22)23/h1-4,7-8H,5-6H2,(H,17,21)(H2,16,18,24)