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2-[1-[2-(3-butylsulfonylphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]ethanenitrile

2-[1-[2-(3-butylsulfonylphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]ethanenitrile

Systemtic Name:2-[1-[2-(3-butylsulfonylphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]ethanenitrile
Openeye Name:2-[1-[2-(3-butylsulfonylphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]acetonitrile
CAS Name:2-[1-[2-(3-butylsulfonylphenyl)ethyl]-6-pyrrolo[1,2-a]pyrazinyl]acetonitrile
IUPAC Name:2-[1-[2-(3-butylsulfonylphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]acetonitrile
Traditional Name:2-[1-[2-(3-butylsulfonylphenyl)ethyl]pyrrolo[1,2-a]pyrazin-6-yl]acetonitrile
Formula: C21H23N3O2S
MolecularWeight: 381.49122
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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=CC=CC(=C1)CCC2=NC=CN3C2=CC=C3CC#N


Isomeric SMILES

CCCCS(=O)(=O)C1=CC=CC(=C1)CCC2=NC=CN3C2=CC=C3CC#N


InChI

InChI=1S/C21H23N3O2S/c1-2-3-15-27(25,26)19-6-4-5-17(16-19)7-9-20-21-10-8-18(11-12-22)24(21)14-13-23-20/h4-6,8,10,13-14,16H,2-3,7,9,11,15H2,1H3


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