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2-[2-[4-(8-cyano-2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]ethylsulfanyl]pyridine-3-carbonitrile

2-[2-[4-(8-cyano-2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]ethylsulfanyl]pyridine-3-carbonitrile

Systemtic Name:2-[2-[4-(8-cyano-2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]ethylsulfanyl]pyridine-3-carbonitrile
Openeye Name:2-[2-[4-(8-cyano-2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]ethylsulfanyl]pyridine-3-carbonitrile
CAS Name:2-[2-[4-(8-cyano-2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]ethylthio]-3-pyridinecarbonitrile
IUPAC Name:2-[2-[4-(8-cyano-2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]ethylsulfanyl]pyridine-3-carbonitrile
Traditional Name:2-[2-[4-(8-cyano-2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]ethylthio]nicotinonitrile
Formula: C21H21N5O2S
MolecularWeight: 407.48874
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCSC2=C(C=CC=N2)C#N)C3=C4C(=C(C=C3)C#N)OCCO4


Isomeric SMILES

C1CN(CCN1CCSC2=C(C=CC=N2)C#N)C3=C4C(=C(C=C3)C#N)OCCO4


InChI

InChI=1S/C21H21N5O2S/c22-14-16-3-4-18(20-19(16)27-11-12-28-20)26-8-6-25(7-9-26)10-13-29-21-17(15-23)2-1-5-24-21/h1-5H,6-13H2


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