3-[(6R,8aS)-6-[2-(6-methoxypyridin-2-yl)ethynyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazine-2-carbonitrile

Systemtic Name: 3-[(6R,8aS)-6-[2-(6-methoxypyridin-2-yl)ethynyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazine-2-carbonitrile Openeye Name: 3-[(6R,8aS)-6-[2-(6-methoxy-2-pyridyl)ethynyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazine-2-carbonitrile CAS Name: 3-[(6R,8aS)-6-[2-(6-methoxy-2-pyridinyl)ethynyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-2-pyrazinecarbonitrile IUPAC Name: 3-[(6R,8aS)-6-[2-(6-methoxypyridin-2-yl)ethynyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazine-2-carbonitrile Traditional Name: 3-[(6R,8aS)-6-[2-(6-methoxy-2-pyridyl)ethynyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazinonitrile Formula: C20H20N6O MolecularWeight: 360.4124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=N1)C#CC2CCC3N2CCN(C3)C4=NC=CN=C4C#N

Isomeric SMILES

COC1=CC=CC(=N1)C#C[C@H]2CC[C@@H]3N2CCN(C3)C4=NC=CN=C4C#N

InChI

InChI=1S/C20H20N6O/c1-27-19-4-2-3-15(24-19)5-6-16-7-8-17-14-25(11-12-26(16)17)20-18(13-21)22-9-10-23-20/h2-4,9-10,16-17H,7-8,11-12,14H2,1H3/t16-,17-/m0/s1