N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(3-oxidanylpiperidin-1-yl)ethanamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(3-oxidanylpiperidin-1-yl)ethanamide Openeye Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(3-hydroxy-1-piperidyl)acetamide CAS Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-2-(3-hydroxy-1-piperidinyl)acetamide IUPAC Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(3-hydroxypiperidin-1-yl)acetamide Traditional Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-2-(3-hydroxypiperidino)acetamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)CN3CCCC(C3)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)CN3CCCC(C3)O

InChI

InChI=1S/C21H26N2O2S/c1-15-5-6-16(2)20(12-15)26-19-9-7-17(8-10-19)22-21(25)14-23-11-3-4-18(24)13-23/h5-10,12,18,24H,3-4,11,13-14H2,1-2H3,(H,22,25)