N-[(3-chlorophenyl)methylcarbamothioyl]-5-nitro-thiophene-3-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methylcarbamothioyl]-5-nitro-thiophene-3-carboxamide Openeye Name: N-[(3-chlorophenyl)methylcarbamothioyl]-5-nitro-thiophene-3-carboxamide CAS Name: N-[[(3-chlorophenyl)methylamino]-sulfanylidenemethyl]-5-nitro-3-thiophenecarboxamide IUPAC Name: N-[(3-chlorophenyl)methylcarbamothioyl]-5-nitrothiophene-3-carboxamide Traditional Name: N-[(3-chlorobenzyl)thiocarbamoyl]-5-nitro-thiophene-3-carboxamide Formula: C13H10ClN3O3S2 MolecularWeight: 355.8198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CNC(=S)NC(=O)C2=CSC(=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CNC(=S)NC(=O)C2=CSC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H10ClN3O3S2/c14-10-3-1-2-8(4-10)6-15-13(21)16-12(18)9-5-11(17(19)20)22-7-9/h1-5,7H,6H2,(H2,15,16,18,21)