(1-phenethylpyrrolo[1,2-a]pyrazin-6-yl) thiocyanate

Systemtic Name: (1-phenethylpyrrolo[1,2-a]pyrazin-6-yl) thiocyanate Openeye Name: (1-phenethylpyrrolo[1,2-a]pyrazin-6-yl) thiocyanate CAS Name: thiocyanic acid (1-phenethyl-6-pyrrolo[1,2-a]pyrazinyl) ester IUPAC Name: (1-phenethylpyrrolo[1,2-a]pyrazin-6-yl) thiocyanate Traditional Name: thiocyanic acid (1-phenethylpyrrolo[1,2-a]pyrazin-6-yl) ester Formula: C16H13N3S MolecularWeight: 279.35952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NC=CN3C2=CC=C3SC#N

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NC=CN3C2=CC=C3SC#N

InChI

InChI=1S/C16H13N3S/c17-12-20-16-9-8-15-14(18-10-11-19(15)16)7-6-13-4-2-1-3-5-13/h1-5,8-11H,6-7H2