methyl N'-(4-nitrophenyl)carbamimidothioate

Systemtic Name: methyl N'-(4-nitrophenyl)carbamimidothioate Openeye Name: 2-methyl-3-(4-nitrophenyl)isothiourea CAS Name: N'-(4-nitrophenyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(4-nitrophenyl)carbamimidothioate Traditional Name: 2-methyl-3-(4-nitrophenyl)isothiourea Formula: C8H9N3O2S MolecularWeight: 211.24096

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC=C(C=C1)[N+](=O)[O-])N

Isomeric SMILES

CSC(=NC1=CC=C(C=C1)[N+](=O)[O-])N

InChI

InChI=1S/C8H9N3O2S/c1-14-8(9)10-6-2-4-7(5-3-6)11(12)13/h2-5H,1H3,(H2,9,10)