5-[[3-[5-methyl-2-(oxolan-2-ylmethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]methyl]quinoxaline

Systemtic Name: 5-[[3-[5-methyl-2-(oxolan-2-ylmethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]methyl]quinoxaline Openeye Name: 5-[[3-[5-methyl-2-(tetrahydrofuran-2-ylmethylsulfanyl)pyrimidin-4-yl]-1-piperidyl]methyl]quinoxaline CAS Name: 5-[[3-[5-methyl-2-(2-oxolanylmethylthio)-4-pyrimidinyl]-1-piperidinyl]methyl]quinoxaline IUPAC Name: 5-[[3-[5-methyl-2-(oxolan-2-ylmethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]methyl]quinoxaline Traditional Name: 5-[[3-[5-methyl-2-(tetrahydrofurfurylthio)pyrimidin-4-yl]piperidino]methyl]quinoxaline Formula: C24H29N5OS MolecularWeight: 435.58496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2CCCN(C2)CC3=C4C(=CC=C3)N=CC=N4)SCC5CCCO5

Isomeric SMILES

CC1=CN=C(N=C1C2CCCN(C2)CC3=C4C(=CC=C3)N=CC=N4)SCC5CCCO5

InChI

InChI=1S/C24H29N5OS/c1-17-13-27-24(31-16-20-7-4-12-30-20)28-22(17)18-6-3-11-29(14-18)15-19-5-2-8-21-23(19)26-10-9-25-21/h2,5,8-10,13,18,20H,3-4,6-7,11-12,14-16H2,1H3