2-[[2-(4-ethoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[[2-(4-ethoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[[2-(4-ethoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]-1-(1-piperidyl)ethanone CAS Name: 2-[[2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[[2-(4-ethoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]-1-piperidin-1-ylethanone Traditional Name: 1-piperidino-2-[(2-p-phenetyl-5H-chromeno[2,3-d]pyrimidin-4-yl)thio]ethanone Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(CC4=CC=CC=C4O3)C(=N2)SCC(=O)N5CCCCC5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(CC4=CC=CC=C4O3)C(=N2)SCC(=O)N5CCCCC5

InChI

InChI=1S/C26H27N3O3S/c1-2-31-20-12-10-18(11-13-20)24-27-25-21(16-19-8-4-5-9-22(19)32-25)26(28-24)33-17-23(30)29-14-6-3-7-15-29/h4-5,8-13H,2-3,6-7,14-17H2,1H3