(3S)-1-(4-methylphenyl)sulfonyl-N'-(2-phenoxyethanoyl)piperidine-3-carbohydrazide

Systemtic Name: (3S)-1-(4-methylphenyl)sulfonyl-N'-(2-phenoxyethanoyl)piperidine-3-carbohydrazide Openeye Name: (3S)-N'-(2-phenoxyacetyl)-1-(p-tolylsulfonyl)piperidine-3-carbohydrazide CAS Name: (3S)-1-(4-methylphenyl)sulfonyl-N'-(1-oxo-2-phenoxyethyl)-3-piperidinecarbohydrazide IUPAC Name: (3S)-1-(4-methylphenyl)sulfonyl-N'-(2-phenoxyacetyl)piperidine-3-carbohydrazide Traditional Name: (3S)-N'-(2-phenoxyacetyl)-1-tosyl-nipecotohydrazide Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NNC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)NNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O5S/c1-16-9-11-19(12-10-16)30(27,28)24-13-5-6-17(14-24)21(26)23-22-20(25)15-29-18-7-3-2-4-8-18/h2-4,7-12,17H,5-6,13-15H2,1H3,(H,22,25)(H,23,26)/t17-/m0/s1