1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butan-1-one

Systemtic Name: 1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butan-1-one Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butan-1-one CAS Name: 1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-butanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butan-1-one Traditional Name: 1-(4-benzylsulfonylpiperazino)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)butan-1-one Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCC2=NC(=NO2)C3=CC=CC=C3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CCCC2=NC(=NO2)C3=CC=CC=C3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O4S/c28-22(13-7-12-21-24-23(25-31-21)20-10-5-2-6-11-20)26-14-16-27(17-15-26)32(29,30)18-19-8-3-1-4-9-19/h1-6,8-11H,7,12-18H2