3-chloranyl-N-(2-dimethylaminoethyl)-4-[1-(thian-4-yl)piperidin-4-yl]oxy-benzamide

Systemtic Name: 3-chloranyl-N-(2-dimethylaminoethyl)-4-[1-(thian-4-yl)piperidin-4-yl]oxy-benzamide Openeye Name: 3-chloro-N-(2-dimethylaminoethyl)-4-[(1-tetrahydrothiopyran-4-yl-4-piperidyl)oxy]benzamide CAS Name: 3-chloro-N-(2-dimethylaminoethyl)-4-[[1-(4-thianyl)-4-piperidinyl]oxy]benzamide IUPAC Name: 3-chloro-N-(2-dimethylaminoethyl)-4-[1-(thian-4-yl)piperidin-4-yl]oxybenzamide Traditional Name: 3-chloro-N-(2-dimethylaminoethyl)-4-[(1-tetrahydrothiopyran-4-yl-4-piperidyl)oxy]benzamide Formula: C21H32ClN3O2S MolecularWeight: 426.01568

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)C3CCSCC3)Cl

Isomeric SMILES

CN(C)CCNC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)C3CCSCC3)Cl

InChI

InChI=1S/C21H32ClN3O2S/c1-24(2)12-9-23-21(26)16-3-4-20(19(22)15-16)27-18-5-10-25(11-6-18)17-7-13-28-14-8-17/h3-4,15,17-18H,5-14H2,1-2H3,(H,23,26)