1-[(3S)-3-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]carbonylpiperidin-1-yl]ethanone

Systemtic Name: 1-[(3S)-3-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]carbonylpiperidin-1-yl]ethanone Openeye Name: 1-[(3S)-3-[4-(4-isopropylphenyl)sulfonylpiperazine-1-carbonyl]-1-piperidyl]ethanone CAS Name: 1-[(3S)-3-[oxo-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]methyl]-1-piperidinyl]ethanone IUPAC Name: 1-[(3S)-3-[4-(4-propan-2-ylphenyl)sulfonylpiperazine-1-carbonyl]piperidin-1-yl]ethanone Traditional Name: 1-[(3S)-3-(4-p-cumenylsulfonylpiperazine-1-carbonyl)piperidino]ethanone Formula: C21H31N3O4S MolecularWeight: 421.55354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCCN(C3)C(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)[C@H]3CCCN(C3)C(=O)C

InChI

InChI=1S/C21H31N3O4S/c1-16(2)18-6-8-20(9-7-18)29(27,28)24-13-11-22(12-14-24)21(26)19-5-4-10-23(15-19)17(3)25/h6-9,16,19H,4-5,10-15H2,1-3H3/t19-/m0/s1