4-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]butanenitrile

Systemtic Name: 4-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]butanenitrile Openeye Name: 4-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazin-1-yl]butanenitrile CAS Name: 4-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-1-piperazinyl]butanenitrile IUPAC Name: 4-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]butanenitrile Traditional Name: 4-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazino]butyronitrile Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCCC#N

InChI

InChI=1S/C18H27N3O2S/c1-3-16(2)17-6-8-18(9-7-17)24(22,23)21-14-12-20(13-15-21)11-5-4-10-19/h6-9,16H,3-5,11-15H2,1-2H3/t16-/m0/s1