ethyl N'-[(E)-(3-nitrophenyl)methylideneamino]carbamimidothioate

Systemtic Name: ethyl N'-[(E)-(3-nitrophenyl)methylideneamino]carbamimidothioate Openeye Name: 2-ethyl-3-[(E)-(3-nitrophenyl)methyleneamino]isothiourea CAS Name: N'-[(E)-(3-nitrophenyl)methylideneamino]carbamimidothioic acid ethyl ester IUPAC Name: ethyl N'-[(E)-(3-nitrophenyl)methylideneamino]carbamimidothioate Traditional Name: 2-ethyl-3-[(E)-(3-nitrobenzylidene)amino]isothiourea Formula: C10H12N4O2S MolecularWeight: 252.29288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N4O2S/c1-2-17-10(11)13-12-7-8-4-3-5-9(6-8)14(15)16/h3-7H,2H2,1H3,(H2,11,13)/b12-7+