methyl N'-[(E)-(4-nitrophenyl)methylideneamino]carbamimidothioate

Systemtic Name: methyl N'-[(E)-(4-nitrophenyl)methylideneamino]carbamimidothioate Openeye Name: 2-methyl-3-[(E)-(4-nitrophenyl)methyleneamino]isothiourea CAS Name: N'-[(E)-(4-nitrophenyl)methylideneamino]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[(E)-(4-nitrophenyl)methylideneamino]carbamimidothioate Traditional Name: 2-methyl-3-[(E)-(4-nitrobenzylidene)amino]isothiourea Formula: C9H10N4O2S MolecularWeight: 238.2663

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NN=CC1=CC=C(C=C1)[N+](=O)[O-])N

Isomeric SMILES

CSC(=N/N=C/C1=CC=C(C=C1)[N+](=O)[O-])N

InChI

InChI=1S/C9H10N4O2S/c1-16-9(10)12-11-6-7-2-4-8(5-3-7)13(14)15/h2-6H,1H3,(H2,10,12)/b11-6+