1-butyl-1-methyl-3-[[(3S)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]carbonylamino]urea

Systemtic Name: 1-butyl-1-methyl-3-[[(3S)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]carbonylamino]urea Openeye Name: 1-butyl-1-methyl-3-[[(3S)-1-(p-tolylsulfonyl)piperidine-3-carbonyl]amino]urea CAS Name: 1-butyl-1-methyl-3-[[[(3S)-1-(4-methylphenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]urea IUPAC Name: 1-butyl-1-methyl-3-[[(3S)-1-(4-methylphenyl)sulfonylpiperidine-3-carbonyl]amino]urea Traditional Name: 1-butyl-1-methyl-3-[[(3S)-1-tosylnipecotoyl]amino]urea Formula: C19H30N4O4S MolecularWeight: 410.5309

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)NNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCN(C)C(=O)NNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H30N4O4S/c1-4-5-12-22(3)19(25)21-20-18(24)16-7-6-13-23(14-16)28(26,27)17-10-8-15(2)9-11-17/h8-11,16H,4-7,12-14H2,1-3H3,(H,20,24)(H,21,25)/t16-/m0/s1