4-(2-methoxyethoxy)-N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-(2-methoxyethoxy)-N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]benzamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: N-[(2-hydroxy-5-nitroanilino)-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: N-[(2-hydroxy-5-nitro-phenyl)thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

COCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H17N3O6S/c1-25-8-9-26-13-5-2-11(3-6-13)16(22)19-17(27)18-14-10-12(20(23)24)4-7-15(14)21/h2-7,10,21H,8-9H2,1H3,(H2,18,19,22,27)