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

Systemtic Name: N-[(5-ethyl-2-oxidanyl-phenyl)carbamothioyl]-2-nitro-benzamide Openeye Name: N-[(5-ethyl-2-hydroxy-phenyl)carbamothioyl]-2-nitro-benzamide CAS Name: N-[(5-ethyl-2-hydroxyanilino)-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[(5-ethyl-2-hydroxyphenyl)carbamothioyl]-2-nitrobenzamide Traditional Name: N-[(5-ethyl-2-hydroxy-phenyl)thiocarbamoyl]-2-nitro-benzamide Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O4S/c1-2-10-7-8-14(20)12(9-10)17-16(24)18-15(21)11-5-3-4-6-13(11)19(22)23/h3-9,20H,2H2,1H3,(H2,17,18,21,24)