1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(4-nitrophenyl)thiourea CAS Name: 1-[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[3-[(4-fluorophenyl)thio]propanoylamino]-3-(4-nitrophenyl)thiourea Formula: C16H15FN4O3S2 MolecularWeight: 394.443703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NNC(=O)CCSC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NNC(=O)CCSC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C16H15FN4O3S2/c17-11-1-7-14(8-2-11)26-10-9-15(22)19-20-16(25)18-12-3-5-13(6-4-12)21(23)24/h1-8H,9-10H2,(H,19,22)(H2,18,20,25)