1-(4-methoxyphenyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiourea

Systemtic Name: 1-(4-methoxyphenyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiourea Openeye Name: 1-(4-methoxyphenyl)-3-[(E)-(5-nitro-2-furyl)methyleneamino]thiourea CAS Name: 1-(4-methoxyphenyl)-3-[(E)-(5-nitro-2-furanyl)methylideneamino]thiourea IUPAC Name: 1-(4-methoxyphenyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiourea Traditional Name: 1-(4-methoxyphenyl)-3-[(E)-(5-nitro-2-furyl)methyleneamino]thiourea Formula: C13H12N4O4S MolecularWeight: 320.32378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NN=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)N/N=C/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O4S/c1-20-10-4-2-9(3-5-10)15-13(22)16-14-8-11-6-7-12(21-11)17(18)19/h2-8H,1H3,(H2,15,16,22)/b14-8+