3-[(6S,8aR)-6-(1-pyridin-4-yl-1,2,3-triazol-4-yl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazine-2-carbonitrile

Systemtic Name: 3-[(6S,8aR)-6-(1-pyridin-4-yl-1,2,3-triazol-4-yl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazine-2-carbonitrile Openeye Name: 3-[(6S,8aR)-6-[1-(4-pyridyl)triazol-4-yl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazine-2-carbonitrile CAS Name: 3-[(6S,8aR)-6-(1-pyridin-4-yl-4-triazolyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-2-pyrazinecarbonitrile IUPAC Name: 3-[(6S,8aR)-6-(1-pyridin-4-yltriazol-4-yl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazine-2-carbonitrile Traditional Name: 3-[(6S,8aR)-6-[1-(4-pyridyl)triazol-4-yl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazinonitrile Formula: C19H19N9 MolecularWeight: 373.41446

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N2C1CN(CC2)C3=NC=CN=C3C#N)C4=CN(N=N4)C5=CC=NC=C5

Isomeric SMILES

C1C[C@H](N2[C@H]1CN(CC2)C3=NC=CN=C3C#N)C4=CN(N=N4)C5=CC=NC=C5

InChI

InChI=1S/C19H19N9/c20-11-16-19(23-8-7-22-16)26-9-10-27-15(12-26)1-2-18(27)17-13-28(25-24-17)14-3-5-21-6-4-14/h3-8,13,15,18H,1-2,9-10,12H2/t15-,18+/m1/s1