2-[[2-(4-ethoxyphenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[[2-(4-ethoxyphenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[[2-(4-ethoxyphenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]-1-(1-piperidyl)ethanone CAS Name: 2-[[2-(4-ethoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[[2-(4-ethoxyphenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]-1-piperidin-1-ylethanone Traditional Name: 2-[(7-methyl-2-p-phenetyl-5H-chromeno[2,3-d]pyrimidin-4-yl)thio]-1-piperidino-ethanone Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(CC4=C(O3)C=CC(=C4)C)C(=N2)SCC(=O)N5CCCCC5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(CC4=C(O3)C=CC(=C4)C)C(=N2)SCC(=O)N5CCCCC5

InChI

InChI=1S/C27H29N3O3S/c1-3-32-21-10-8-19(9-11-21)25-28-26-22(16-20-15-18(2)7-12-23(20)33-26)27(29-25)34-17-24(31)30-13-5-4-6-14-30/h7-12,15H,3-6,13-14,16-17H2,1-2H3