4-[2-[2-(4-nitrophenoxy)ethanoylcarbamothioyl]hydrazinyl]-4-oxidanylidene-N-phenyl-butanamide

Systemtic Name: 4-[2-[2-(4-nitrophenoxy)ethanoylcarbamothioyl]hydrazinyl]-4-oxidanylidene-N-phenyl-butanamide Openeye Name: 4-[2-[[2-(4-nitrophenoxy)acetyl]carbamothioyl]hydrazino]-4-oxo-N-phenyl-butanamide CAS Name: 4-[[[[2-(4-nitrophenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]hydrazo]-4-oxo-N-phenylbutanamide IUPAC Name: 4-[2-[[2-(4-nitrophenoxy)acetyl]carbamothioyl]hydrazinyl]-4-oxo-N-phenylbutanamide Traditional Name: 4-keto-4-[N'-[[2-(4-nitrophenoxy)acetyl]thiocarbamoyl]hydrazino]-N-phenyl-butyramide Formula: C19H19N5O6S MolecularWeight: 445.44906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O6S/c25-16(20-13-4-2-1-3-5-13)10-11-17(26)22-23-19(31)21-18(27)12-30-15-8-6-14(7-9-15)24(28)29/h1-9H,10-12H2,(H,20,25)(H,22,26)(H2,21,23,27,31)