2-[4-(3,5-dimethylpiperidin-1-yl)sulfonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(3,5-dimethylpiperidin-1-yl)sulfonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(3,5-dimethylpiperidin-1-yl)sulfonylpiperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(3,5-dimethylpiperidino)sulfonylpiperazino]sulfonylbenzonitrile Formula: C18H26N4O4S2 MolecularWeight: 426.55344

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C

InChI

InChI=1S/C18H26N4O4S2/c1-15-11-16(2)14-22(13-15)28(25,26)21-9-7-20(8-10-21)27(23,24)18-6-4-3-5-17(18)12-19/h3-6,15-16H,7-11,13-14H2,1-2H3