2-[(4-propan-2-ylpiperazin-1-yl)sulfonylmethyl]benzenecarbonitrile

Systemtic Name: 2-[(4-propan-2-ylpiperazin-1-yl)sulfonylmethyl]benzenecarbonitrile Openeye Name: 2-[(4-isopropylpiperazin-1-yl)sulfonylmethyl]benzonitrile CAS Name: 2-[(4-propan-2-yl-1-piperazinyl)sulfonylmethyl]benzonitrile IUPAC Name: 2-[(4-propan-2-ylpiperazin-1-yl)sulfonylmethyl]benzonitrile Traditional Name: 2-[(4-isopropylpiperazino)sulfonylmethyl]benzonitrile Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2C#N

Isomeric SMILES

CC(C)N1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2C#N

InChI

InChI=1S/C15H21N3O2S/c1-13(2)17-7-9-18(10-8-17)21(19,20)12-15-6-4-3-5-14(15)11-16/h3-6,13H,7-10,12H2,1-2H3