methyl N-[(2-azanyl-5-nitro-phenyl)carbamothioyl]carbamate

Systemtic Name: methyl N-[(2-azanyl-5-nitro-phenyl)carbamothioyl]carbamate Openeye Name: methyl N-[(2-amino-5-nitro-phenyl)carbamothioyl]carbamate CAS Name: N-[(2-amino-5-nitroanilino)-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[(2-amino-5-nitrophenyl)carbamothioyl]carbamate Traditional Name: N-[(2-amino-5-nitro-phenyl)thiocarbamoyl]carbamic acid methyl ester Formula: C9H10N4O4S MolecularWeight: 270.2651

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N4O4S/c1-17-9(14)12-8(18)11-7-4-5(13(15)16)2-3-6(7)10/h2-4H,10H2,1H3,(H2,11,12,14,18)