4-[4-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]phenyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]phenyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]phenyl]-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]benzoyl]piperazino]sulfonylbenzonitrile Formula: C22H21N5O4S2 MolecularWeight: 483.56324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)CSC2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=NOC(=N1)CSC2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H21N5O4S2/c1-16-24-21(31-25-16)15-32-19-6-4-18(5-7-19)22(28)26-10-12-27(13-11-26)33(29,30)20-8-2-17(14-23)3-9-20/h2-9H,10-13,15H2,1H3