2-(1-phenethyl-8-propylsulfanyl-pyrrolo[1,2-a]pyrazin-6-yl)ethanenitrile

Systemtic Name: 2-(1-phenethyl-8-propylsulfanyl-pyrrolo[1,2-a]pyrazin-6-yl)ethanenitrile Openeye Name: 2-(1-phenethyl-8-propylsulfanyl-pyrrolo[1,2-a]pyrazin-6-yl)acetonitrile CAS Name: 2-[1-phenethyl-8-(propylthio)-6-pyrrolo[1,2-a]pyrazinyl]acetonitrile IUPAC Name: 2-(1-phenethyl-8-propylsulfanylpyrrolo[1,2-a]pyrazin-6-yl)acetonitrile Traditional Name: 2-[1-phenethyl-8-(propylthio)pyrrolo[1,2-a]pyrazin-6-yl]acetonitrile Formula: C20H21N3S MolecularWeight: 335.46584

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C2C(=NC=CN2C(=C1)CC#N)CCC3=CC=CC=C3

Isomeric SMILES

CCCSC1=C2C(=NC=CN2C(=C1)CC#N)CCC3=CC=CC=C3

InChI

InChI=1S/C20H21N3S/c1-2-14-24-19-15-17(10-11-21)23-13-12-22-18(20(19)23)9-8-16-6-4-3-5-7-16/h3-7,12-13,15H,2,8-10,14H2,1H3