1-[(4-fluorophenyl)methyl]-3-[(Z)-(5-nitrofuran-2-yl)methylideneamino]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[(Z)-(5-nitrofuran-2-yl)methylideneamino]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[(Z)-(5-nitro-2-furyl)methyleneamino]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[(Z)-(5-nitro-2-furanyl)methylideneamino]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[(Z)-(5-nitrofuran-2-yl)methylideneamino]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[(Z)-(5-nitro-2-furyl)methyleneamino]thiourea Formula: C13H11FN4O3S MolecularWeight: 322.314843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=S)NN=CC2=CC=C(O2)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1CNC(=S)N/N=C\C2=CC=C(O2)[N+](=O)[O-])F

InChI

InChI=1S/C13H11FN4O3S/c14-10-3-1-9(2-4-10)7-15-13(22)17-16-8-11-5-6-12(21-11)18(19)20/h1-6,8H,7H2,(H2,15,17,22)/b16-8-