2-[4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]carbothioyl-2-methoxy-phenoxy]ethanamide

Systemtic Name: 2-[4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]carbothioyl-2-methoxy-phenoxy]ethanamide Openeye Name: 2-[4-[4-(4-chlorophenyl)-4-hydroxy-piperidine-1-carbothioyl]-2-methoxy-phenoxy]acetamide CAS Name: 2-[4-[[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-sulfanylidenemethyl]-2-methoxyphenoxy]acetamide IUPAC Name: 2-[4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbothioyl]-2-methoxyphenoxy]acetamide Traditional Name: 2-[4-[4-(4-chlorophenyl)-4-hydroxy-piperidine-1-carbothioyl]-2-methoxy-phenoxy]acetamide Formula: C21H23ClN2O4S MolecularWeight: 434.93632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=S)N2CCC(CC2)(C3=CC=C(C=C3)Cl)O)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)C(=S)N2CCC(CC2)(C3=CC=C(C=C3)Cl)O)OCC(=O)N

InChI

InChI=1S/C21H23ClN2O4S/c1-27-18-12-14(2-7-17(18)28-13-19(23)25)20(29)24-10-8-21(26,9-11-24)15-3-5-16(22)6-4-15/h2-7,12,26H,8-11,13H2,1H3,(H2,23,25)