4-butan-2-yloxy-N-[(4-nitro-2-oxidanyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-butan-2-yloxy-N-[(4-nitro-2-oxidanyl-phenyl)carbamothioyl]benzamide Openeye Name: N-[(2-hydroxy-4-nitro-phenyl)carbamothioyl]-4-sec-butoxy-benzamide CAS Name: 4-butan-2-yloxy-N-[(2-hydroxy-4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butan-2-yloxy-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]benzamide Traditional Name: N-[(2-hydroxy-4-nitro-phenyl)thiocarbamoyl]-4-sec-butoxy-benzamide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C18H19N3O5S/c1-3-11(2)26-14-7-4-12(5-8-14)17(23)20-18(27)19-15-9-6-13(21(24)25)10-16(15)22/h4-11,22H,3H2,1-2H3,(H2,19,20,23,27)