methyl N'-[(4-nitrophenyl)carbonylamino]carbamimidothioate

Systemtic Name: methyl N'-[(4-nitrophenyl)carbonylamino]carbamimidothioate Openeye Name: N-[(E)-[amino(methylsulfanyl)methylene]amino]-4-nitro-benzamide CAS Name: N'-[[(4-nitrophenyl)-oxomethyl]amino]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[(4-nitrobenzoyl)amino]carbamimidothioate Traditional Name: N-[(E)-[amino-(methylthio)methylene]amino]-4-nitro-benzamide Formula: C9H10N4O3S MolecularWeight: 254.2657

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N4O3S/c1-17-9(10)12-11-8(14)6-2-4-7(5-3-6)13(15)16/h2-5H,1H3,(H2,10,12)(H,11,14)