(4-nitrophenyl)methyl N'-ethylcarbamimidothioate

Systemtic Name: (4-nitrophenyl)methyl N'-ethylcarbamimidothioate Openeye Name: 3-ethyl-2-[(4-nitrophenyl)methyl]isothiourea CAS Name: N'-ethylcarbamimidothioic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N'-ethylcarbamimidothioate Traditional Name: 3-ethyl-2-(4-nitrobenzyl)isothiourea Formula: C10H13N3O2S MolecularWeight: 239.29412

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(N)SCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCN=C(N)SCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C10H13N3O2S/c1-2-12-10(11)16-7-8-3-5-9(6-4-8)13(14)15/h3-6H,2,7H2,1H3,(H2,11,12)