1-[4-(4-chlorophenyl)-2-(1,3-oxazol-5-yl)-4-oxidanyl-2-propylsulfanyl-piperidin-1-yl]propan-1-one

Systemtic Name: 1-[4-(4-chlorophenyl)-2-(1,3-oxazol-5-yl)-4-oxidanyl-2-propylsulfanyl-piperidin-1-yl]propan-1-one Openeye Name: 1-[4-(4-chlorophenyl)-4-hydroxy-2-oxazol-5-yl-2-propylsulfanyl-1-piperidyl]propan-1-one CAS Name: 1-[4-(4-chlorophenyl)-4-hydroxy-2-(5-oxazolyl)-2-(propylthio)-1-piperidinyl]-1-propanone IUPAC Name: 1-[4-(4-chlorophenyl)-4-hydroxy-2-(1,3-oxazol-5-yl)-2-propylsulfanylpiperidin-1-yl]propan-1-one Traditional Name: 1-[4-(4-chlorophenyl)-4-hydroxy-2-oxazol-5-yl-2-(propylthio)piperidino]propan-1-one Formula: C20H25ClN2O3S MolecularWeight: 408.9421

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1(CC(CCN1C(=O)CC)(C2=CC=C(C=C2)Cl)O)C3=CN=CO3

Isomeric SMILES

CCCSC1(CC(CCN1C(=O)CC)(C2=CC=C(C=C2)Cl)O)C3=CN=CO3

InChI

InChI=1S/C20H25ClN2O3S/c1-3-11-27-20(17-12-22-14-26-17)13-19(25,9-10-23(20)18(24)4-2)15-5-7-16(21)8-6-15/h5-8,12,14,25H,3-4,9-11,13H2,1-2H3