N'-[2-(4-methylphenyl)sulfanylethanoyl]-1-(2-nitrophenyl)piperidine-4-carbohydrazide

Systemtic Name: N'-[2-(4-methylphenyl)sulfanylethanoyl]-1-(2-nitrophenyl)piperidine-4-carbohydrazide Openeye Name: 1-(2-nitrophenyl)-N'-[2-(p-tolylsulfanyl)acetyl]piperidine-4-carbohydrazide CAS Name: N'-[2-[(4-methylphenyl)thio]-1-oxoethyl]-1-(2-nitrophenyl)-4-piperidinecarbohydrazide IUPAC Name: N'-[2-(4-methylphenyl)sulfanylacetyl]-1-(2-nitrophenyl)piperidine-4-carbohydrazide Traditional Name: 1-(2-nitrophenyl)-N'-[2-(p-tolylthio)acetyl]isonipecotohydrazide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O4S/c1-15-6-8-17(9-7-15)30-14-20(26)22-23-21(27)16-10-12-24(13-11-16)18-4-2-3-5-19(18)25(28)29/h2-9,16H,10-14H2,1H3,(H,22,26)(H,23,27)