1-[(4-fluorophenyl)methyl]-3-[2-(4-nitrophenyl)sulfanylethanoylamino]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[2-(4-nitrophenyl)sulfanylethanoylamino]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[[2-(4-nitrophenyl)sulfanylacetyl]amino]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[[2-(4-nitrophenyl)sulfanylacetyl]amino]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[[2-[(4-nitrophenyl)thio]acetyl]amino]thiourea Formula: C16H15FN4O3S2 MolecularWeight: 394.443703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=S)NNC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1CNC(=S)NNC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])F

InChI

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