3-[3-[[4-(phenylmethyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[3-[[4-(phenylmethyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[3-[(4-benzylsulfonylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[3-[[4-(phenylmethyl)sulfonyl-1-piperazinyl]methyl]-1,2,4-oxadiazol-5-yl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[3-[(4-benzylsulfonylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[3-[(4-benzylsulfonylpiperazino)methyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidino-propan-1-one Formula: C21H29N5O4S MolecularWeight: 447.55106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCC2=NC(=NO2)CN3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)CCC2=NC(=NO2)CN3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H29N5O4S/c27-21(25-10-4-5-11-25)9-8-20-22-19(23-30-20)16-24-12-14-26(15-13-24)31(28,29)17-18-6-2-1-3-7-18/h1-3,6-7H,4-5,8-17H2