2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-N-[2-(methylthio)phenyl]acetamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)CN2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)CN2CCC[C@H](C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H23N3OS2/c1-26-18-10-4-2-8-16(18)22-20(25)14-24-12-6-7-15(13-24)21-23-17-9-3-5-11-19(17)27-21/h2-5,8-11,15H,6-7,12-14H2,1H3,(H,22,25)/t15-/m1/s1