(2R)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: (2R)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: (2R)-2-(4-benzylsulfonylpiperazin-1-yl)-1-pyrrolidin-1-yl-propan-1-one CAS Name: (2R)-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: (2R)-2-(4-benzylsulfonylpiperazin-1-yl)-1-pyrrolidin-1-ylpropan-1-one Traditional Name: (2R)-2-(4-benzylsulfonylpiperazino)-1-pyrrolidino-propan-1-one Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)N1CCCC1)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H27N3O3S/c1-16(18(22)20-9-5-6-10-20)19-11-13-21(14-12-19)25(23,24)15-17-7-3-2-4-8-17/h2-4,7-8,16H,5-6,9-15H2,1H3/t16-/m1/s1