methyl N-[(4-aminocarbonylsulfanyl-2-nitro-phenyl)carbamothioyl]carbamate

Systemtic Name: methyl N-[(4-aminocarbonylsulfanyl-2-nitro-phenyl)carbamothioyl]carbamate Openeye Name: methyl N-[(4-carbamoylsulfanyl-2-nitro-phenyl)carbamothioyl]carbamate CAS Name: N-[[4-(carbamoylthio)-2-nitroanilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[(4-carbamoylsulfanyl-2-nitrophenyl)carbamothioyl]carbamate Traditional Name: N-[[4-(carbamoylthio)-2-nitro-phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C10H10N4O5S2 MolecularWeight: 330.3402

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=S)NC1=C(C=C(C=C1)SC(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC(=O)NC(=S)NC1=C(C=C(C=C1)SC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C10H10N4O5S2/c1-19-10(16)13-9(20)12-6-3-2-5(21-8(11)15)4-7(6)14(17)18/h2-4H,1H3,(H2,11,15)(H2,12,13,16,20)