2-[3-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]piperazin-1-yl]propoxy]-5-pyridin-2-ylcarbonyl-benzenecarbonitrile

Systemtic Name: 2-[3-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]piperazin-1-yl]propoxy]-5-pyridin-2-ylcarbonyl-benzenecarbonitrile Openeye Name: 2-[3-[4-(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)piperazin-1-yl]propoxy]-5-(pyridine-2-carbonyl)benzonitrile CAS Name: 2-[3-[4-(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-1-piperazinyl]propoxy]-5-[oxo(2-pyridinyl)methyl]benzonitrile IUPAC Name: 2-[3-[4-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperazin-1-yl]propoxy]-5-(pyridine-2-carbonyl)benzonitrile Traditional Name: 2-[3-[4-(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)piperazino]propoxy]-5-picolinoyl-benzonitrile Formula: C26H28N6O4 MolecularWeight: 488.53832

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)CCCOC3=C(C=C(C=C3)C(=O)C4=CC=CC=N4)C#N

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)CCCOC3=C(C=C(C=C3)C(=O)C4=CC=CC=N4)C#N

InChI

InChI=1S/C26H28N6O4/c1-29-23(17-24(33)30(2)26(29)35)32-13-11-31(12-14-32)10-5-15-36-22-8-7-19(16-20(22)18-27)25(34)21-6-3-4-9-28-21/h3-4,6-9,16-17H,5,10-15H2,1-2H3