4-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]butanenitrile

Systemtic Name: 4-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]butanenitrile Openeye Name: 4-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]butanenitrile CAS Name: 4-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]butanenitrile IUPAC Name: 4-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]butanenitrile Traditional Name: 4-(4-p-cumenylsulfonylpiperazino)butyronitrile Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCCC#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCCC#N

InChI

InChI=1S/C17H25N3O2S/c1-15(2)16-5-7-17(8-6-16)23(21,22)20-13-11-19(12-14-20)10-4-3-9-18/h5-8,15H,3-4,10-14H2,1-2H3