N-[(2-methoxy-5-nitro-phenyl)carbamothioyl]cyclopropanecarboxamide

Systemtic Name: N-[(2-methoxy-5-nitro-phenyl)carbamothioyl]cyclopropanecarboxamide Openeye Name: N-[(2-methoxy-5-nitro-phenyl)carbamothioyl]cyclopropanecarboxamide CAS Name: N-[(2-methoxy-5-nitroanilino)-sulfanylidenemethyl]cyclopropanecarboxamide IUPAC Name: N-[(2-methoxy-5-nitrophenyl)carbamothioyl]cyclopropanecarboxamide Traditional Name: N-[(2-methoxy-5-nitro-phenyl)thiocarbamoyl]cyclopropanecarboxamide Formula: C12H13N3O4S MolecularWeight: 295.31432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)C2CC2

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)C2CC2

InChI

InChI=1S/C12H13N3O4S/c1-19-10-5-4-8(15(17)18)6-9(10)13-12(20)14-11(16)7-2-3-7/h4-7H,2-3H2,1H3,(H2,13,14,16,20)