4-[8-(furan-2-ylmethylsulfanyl)-2-piperazin-1-yl-pyrimido[5,4-d]pyrimidin-4-yl]morpholine

Systemtic Name: 4-[8-(furan-2-ylmethylsulfanyl)-2-piperazin-1-yl-pyrimido[5,4-d]pyrimidin-4-yl]morpholine Openeye Name: 4-[8-(2-furylmethylsulfanyl)-2-piperazin-1-yl-pyrimido[5,4-d]pyrimidin-4-yl]morpholine CAS Name: 4-[8-(2-furanylmethylthio)-2-(1-piperazinyl)-4-pyrimido[5,4-d]pyrimidinyl]morpholine IUPAC Name: 4-[8-(furan-2-ylmethylsulfanyl)-2-piperazin-1-ylpyrimido[5,4-d]pyrimidin-4-yl]morpholine Traditional Name: 4-[8-(2-furfurylthio)-2-piperazino-pyrimido[5,4-d]pyrimidin-4-yl]morpholine Formula: C19H23N7O2S MolecularWeight: 413.49662

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=C(C(=N2)N4CCOCC4)N=CN=C3SCC5=CC=CO5

Isomeric SMILES

C1CN(CCN1)C2=NC3=C(C(=N2)N4CCOCC4)N=CN=C3SCC5=CC=CO5

InChI

InChI=1S/C19H23N7O2S/c1-2-14(28-9-1)12-29-18-16-15(21-13-22-18)17(25-7-10-27-11-8-25)24-19(23-16)26-5-3-20-4-6-26/h1-2,9,13,20H,3-8,10-12H2