2-[8-ethyl-1-[2-(4-ethylsulfanylphenyl)ethyl]-7-methyl-pyrrolo[1,2-a]pyrazin-6-yl]ethanenitrile

Systemtic Name: 2-[8-ethyl-1-[2-(4-ethylsulfanylphenyl)ethyl]-7-methyl-pyrrolo[1,2-a]pyrazin-6-yl]ethanenitrile Openeye Name: 2-[8-ethyl-1-[2-(4-ethylsulfanylphenyl)ethyl]-7-methyl-pyrrolo[1,2-a]pyrazin-6-yl]acetonitrile CAS Name: 2-[8-ethyl-1-[2-[4-(ethylthio)phenyl]ethyl]-7-methyl-6-pyrrolo[1,2-a]pyrazinyl]acetonitrile IUPAC Name: 2-[8-ethyl-1-[2-(4-ethylsulfanylphenyl)ethyl]-7-methylpyrrolo[1,2-a]pyrazin-6-yl]acetonitrile Traditional Name: 2-[8-ethyl-1-[2-[4-(ethylthio)phenyl]ethyl]-7-methyl-pyrrolo[1,2-a]pyrazin-6-yl]acetonitrile Formula: C22H25N3S MolecularWeight: 363.519

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NC=CN2C(=C1C)CC#N)CCC3=CC=C(C=C3)SCC

Isomeric SMILES

CCC1=C2C(=NC=CN2C(=C1C)CC#N)CCC3=CC=C(C=C3)SCC

InChI

InChI=1S/C22H25N3S/c1-4-19-16(3)21(12-13-23)25-15-14-24-20(22(19)25)11-8-17-6-9-18(10-7-17)26-5-2/h6-7,9-10,14-15H,4-5,8,11-12H2,1-3H3