3-[(6S,8aR)-6-[1-(2-methylpyridin-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-(2-methylpyridin-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-(2-methyl-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-(2-methyl-4-pyridinyl)-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-(2-methylpyridin-4-yl)triazol-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-(2-methyl-4-pyridyl)triazol-4-yl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]pyrazinonitrile Formula: C20H21N9 MolecularWeight: 387.44104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)N2C=C(N=N2)C3CCC4N3CCN(C4)C5=NC=CN=C5C#N

Isomeric SMILES

CC1=NC=CC(=C1)N2C=C(N=N2)[C@@H]3CC[C@H]4N3CCN(C4)C5=NC=CN=C5C#N

InChI

InChI=1S/C20H21N9/c1-14-10-15(4-5-22-14)29-13-18(25-26-29)19-3-2-16-12-27(8-9-28(16)19)20-17(11-21)23-6-7-24-20/h4-7,10,13,16,19H,2-3,8-9,12H2,1H3/t16-,19+/m1/s1