(3S)-N'-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-1-pyrimidin-2-yl-piperidine-3-carbohydrazide

Systemtic Name: (3S)-N'-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-1-pyrimidin-2-yl-piperidine-3-carbohydrazide Openeye Name: (3S)-N'-[1-(p-tolylsulfonyl)piperidine-4-carbonyl]-1-pyrimidin-2-yl-piperidine-3-carbohydrazide CAS Name: (3S)-N'-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-1-(2-pyrimidinyl)-3-piperidinecarbohydrazide IUPAC Name: (3S)-N'-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]-1-pyrimidin-2-ylpiperidine-3-carbohydrazide Traditional Name: (3S)-1-(2-pyrimidyl)-N'-(1-tosylisonipecotoyl)nipecotohydrazide Formula: C23H30N6O4S MolecularWeight: 486.5871

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NNC(=O)C3CCCN(C3)C4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NNC(=O)[C@H]3CCCN(C3)C4=NC=CC=N4

InChI

InChI=1S/C23H30N6O4S/c1-17-5-7-20(8-6-17)34(32,33)29-14-9-18(10-15-29)21(30)26-27-22(31)19-4-2-13-28(16-19)23-24-11-3-12-25-23/h3,5-8,11-12,18-19H,2,4,9-10,13-16H2,1H3,(H,26,30)(H,27,31)/t19-/m0/s1