3-[4-[6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]pyrazine-2-carbonitrile

Systemtic Name: 3-[4-[6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]pyrazine-2-carbonitrile Openeye Name: 3-[4-[6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]pyrazine-2-carbonitrile CAS Name: 3-[4-[6-(2,6-dimethyl-4-morpholinyl)-5-nitro-4-pyrimidinyl]-1-piperazinyl]-2-pyrazinecarbonitrile IUPAC Name: 3-[4-[6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-yl]piperazin-1-yl]pyrazine-2-carbonitrile Traditional Name: 3-[4-[6-(2,6-dimethylmorpholino)-5-nitro-pyrimidin-4-yl]piperazino]pyrazinonitrile Formula: C19H23N9O3 MolecularWeight: 425.44442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=NC=CN=C4C#N

Isomeric SMILES

CC1CN(CC(O1)C)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=NC=CN=C4C#N

InChI

InChI=1S/C19H23N9O3/c1-13-10-27(11-14(2)31-13)19-16(28(29)30)18(23-12-24-19)26-7-5-25(6-8-26)17-15(9-20)21-3-4-22-17/h3-4,12-14H,5-8,10-11H2,1-2H3