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

Systemtic Name: 1-[2-[[3-methyl-3-oxidanyl-1-(1-thiophen-2-ylethyl)piperidin-4-yl]amino]phenyl]propan-1-one Openeye Name: 1-[2-[[3-hydroxy-3-methyl-1-[1-(2-thienyl)ethyl]-4-piperidyl]amino]phenyl]propan-1-one CAS Name: 1-[2-[[3-hydroxy-3-methyl-1-(1-thiophen-2-ylethyl)-4-piperidinyl]amino]phenyl]-1-propanone IUPAC Name: 1-[2-[[3-hydroxy-3-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-yl]amino]phenyl]propan-1-one Traditional Name: 1-[2-[[3-hydroxy-3-methyl-1-[1-(2-thienyl)ethyl]-4-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=CC=C1NC2CCN(CC2(C)O)C(C)C3=CC=CS3

Isomeric SMILES

CCC(=O)C1=CC=CC=C1NC2CCN(CC2(C)O)C(C)C3=CC=CS3

InChI

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