2-(7-ethylsulfanyl-1-phenethyl-pyrrolo[1,2-a]pyrazin-6-yl)ethanenitrile

Systemtic Name: 2-(7-ethylsulfanyl-1-phenethyl-pyrrolo[1,2-a]pyrazin-6-yl)ethanenitrile Openeye Name: 2-(7-ethylsulfanyl-1-phenethyl-pyrrolo[1,2-a]pyrazin-6-yl)acetonitrile CAS Name: 2-[7-(ethylthio)-1-phenethyl-6-pyrrolo[1,2-a]pyrazinyl]acetonitrile IUPAC Name: 2-(7-ethylsulfanyl-1-phenethylpyrrolo[1,2-a]pyrazin-6-yl)acetonitrile Traditional Name: 2-[7-(ethylthio)-1-phenethyl-pyrrolo[1,2-a]pyrazin-6-yl]acetonitrile Formula: C19H19N3S MolecularWeight: 321.43926

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(N2C=CN=C(C2=C1)CCC3=CC=CC=C3)CC#N

Isomeric SMILES

CCSC1=C(N2C=CN=C(C2=C1)CCC3=CC=CC=C3)CC#N

InChI

InChI=1S/C19H19N3S/c1-2-23-19-14-18-16(9-8-15-6-4-3-5-7-15)21-12-13-22(18)17(19)10-11-20/h3-7,12-14H,2,8-10H2,1H3