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2-[methylsulfanyl-[6-[3-(piperidin-1-ylmethyl)phenoxy]hexylamino]methylidene]propanedinitrile

2-[methylsulfanyl-[6-[3-(piperidin-1-ylmethyl)phenoxy]hexylamino]methylidene]propanedinitrile

Systemtic Name:2-[methylsulfanyl-[6-[3-(piperidin-1-ylmethyl)phenoxy]hexylamino]methylidene]propanedinitrile
Openeye Name:2-[methylsulfanyl-[6-[3-(1-piperidylmethyl)phenoxy]hexylamino]methylene]propanedinitrile
CAS Name:2-[(methylthio)-[6-[3-(1-piperidinylmethyl)phenoxy]hexylamino]methylidene]propanedinitrile
IUPAC Name:2-[methylsulfanyl-[6-[3-(piperidin-1-ylmethyl)phenoxy]hexylamino]methylidene]propanedinitrile
Traditional Name:2-[(methylthio)-[6-[3-(piperidinomethyl)phenoxy]hexylamino]methylene]malononitrile
Formula: C23H32N4OS
MolecularWeight: 412.59138
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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C#N)C#N)NCCCCCCOC1=CC=CC(=C1)CN2CCCCC2


Isomeric SMILES

CSC(=C(C#N)C#N)NCCCCCCOC1=CC=CC(=C1)CN2CCCCC2


InChI

InChI=1S/C23H32N4OS/c1-29-23(21(17-24)18-25)26-12-5-2-3-8-15-28-22-11-9-10-20(16-22)19-27-13-6-4-7-14-27/h9-11,16,26H,2-8,12-15,19H2,1H3


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