3-[(6R,8aS)-6-(2-pyridin-2-ylethynyl)-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-pyridin-2-ylethynyl)-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-(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-(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-pyridin-2-ylethynyl)-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-(2-pyridyl)ethynyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazinonitrile Formula: C19H18N6 MolecularWeight: 330.38642

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N2C1CN(CC2)C3=NC=CN=C3C#N)C#CC4=CC=CC=N4

Isomeric SMILES

C1C[C@@H](N2[C@@H]1CN(CC2)C3=NC=CN=C3C#N)C#CC4=CC=CC=N4

InChI

InChI=1S/C19H18N6/c20-13-18-19(23-10-9-22-18)24-11-12-25-16(6-7-17(25)14-24)5-4-15-3-1-2-8-21-15/h1-3,8-10,16-17H,6-7,11-12,14H2/t16-,17-/m0/s1