[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-[(2S)-1-(p-tolylsulfonyl)pyrrolidin-2-yl]methanone CAS Name: [(2S)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methanone Traditional Name: (4-benzylsulfonylpiperazino)-[(2S)-1-tosylpyrrolidin-2-yl]methanone Formula: C23H29N3O5S2 MolecularWeight: 491.62346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H29N3O5S2/c1-19-9-11-21(12-10-19)33(30,31)26-13-5-8-22(26)23(27)24-14-16-25(17-15-24)32(28,29)18-20-6-3-2-4-7-20/h2-4,6-7,9-12,22H,5,8,13-18H2,1H3/t22-/m0/s1