2-[[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-1-(4-piperidin-1-ylpiperidin-1-yl)ethanone

Systemtic Name: 2-[[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-1-(4-piperidin-1-ylpiperidin-1-yl)ethanone Openeye Name: 2-[[2-(4-ethoxyphenyl)-5-methyl-oxazol-4-yl]methylsulfanyl]-1-[4-(1-piperidyl)-1-piperidyl]ethanone CAS Name: 2-[[2-(4-ethoxyphenyl)-5-methyl-4-oxazolyl]methylthio]-1-[4-(1-piperidinyl)-1-piperidinyl]ethanone IUPAC Name: 2-[[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-1-(4-piperidin-1-ylpiperidin-1-yl)ethanone Traditional Name: 2-[(5-methyl-2-p-phenetyl-oxazol-4-yl)methylthio]-1-(4-piperidinopiperidino)ethanone Formula: C25H35N3O3S MolecularWeight: 457.6287

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=C(O2)C)CSCC(=O)N3CCC(CC3)N4CCCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(O2)C)CSCC(=O)N3CCC(CC3)N4CCCCC4

InChI

InChI=1S/C25H35N3O3S/c1-3-30-22-9-7-20(8-10-22)25-26-23(19(2)31-25)17-32-18-24(29)28-15-11-21(12-16-28)27-13-5-4-6-14-27/h7-10,21H,3-6,11-18H2,1-2H3