1-[4-[[3-methyl-3-oxidanyl-1-(1-thiophen-2-ylethyl)piperidin-2-yl]amino]phenyl]propan-1-one

Systemtic Name: 1-[4-[[3-methyl-3-oxidanyl-1-(1-thiophen-2-ylethyl)piperidin-2-yl]amino]phenyl]propan-1-one Openeye Name: 1-[4-[[3-hydroxy-3-methyl-1-[1-(2-thienyl)ethyl]-2-piperidyl]amino]phenyl]propan-1-one CAS Name: 1-[4-[[3-hydroxy-3-methyl-1-(1-thiophen-2-ylethyl)-2-piperidinyl]amino]phenyl]-1-propanone IUPAC Name: 1-[4-[[3-hydroxy-3-methyl-1-(1-thiophen-2-ylethyl)piperidin-2-yl]amino]phenyl]propan-1-one Traditional Name: 1-[4-[[3-hydroxy-3-methyl-1-[1-(2-thienyl)ethyl]-2-piperidyl]amino]phenyl]propan-1-one Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)NC2C(CCCN2C(C)C3=CC=CS3)(C)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)NC2C(CCCN2C(C)C3=CC=CS3)(C)O

InChI

InChI=1S/C21H28N2O2S/c1-4-18(24)16-8-10-17(11-9-16)22-20-21(3,25)12-6-13-23(20)15(2)19-7-5-14-26-19/h5,7-11,14-15,20,22,25H,4,6,12-13H2,1-3H3