methyl N-[(2-chloranyl-1,3-thiazol-5-yl)methyl]-N'-nitro-N-propanoyl-carbamimidothioate

Systemtic Name: methyl N-[(2-chloranyl-1,3-thiazol-5-yl)methyl]-N'-nitro-N-propanoyl-carbamimidothioate Openeye Name: N-[(2-chlorothiazol-5-yl)methyl]-N-[(Z)-C-methylsulfanyl-N-nitro-carbonimidoyl]propanamide CAS Name: N-[(2-chloro-5-thiazolyl)methyl]-N'-nitro-N-(1-oxopropyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N-[(2-chloro-1,3-thiazol-5-yl)methyl]-N'-nitro-N-propanoylcarbamimidothioate Traditional Name: N-[(2-chlorothiazol-5-yl)methyl]-N-[(Z)-C-(methylthio)-N-nitro-carbonimidoyl]propionamide Formula: C9H11ClN4O3S2 MolecularWeight: 322.79164

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC1=CN=C(S1)Cl)C(=N[N+](=O)[O-])SC

Isomeric SMILES

CCC(=O)N(CC1=CN=C(S1)Cl)/C(=N/[N+](=O)[O-])/SC

InChI

InChI=1S/C9H11ClN4O3S2/c1-3-7(15)13(9(18-2)12-14(16)17)5-6-4-11-8(10)19-6/h4H,3,5H2,1-2H3/b12-9-