(2S)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(4-methylphenoxy)propan-1-one

Systemtic Name: (2S)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(4-methylphenoxy)propan-1-one Openeye Name: (2S)-1-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-(4-methylphenoxy)propan-1-one CAS Name: (2S)-1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-(4-methylphenoxy)-1-propanone IUPAC Name: (2S)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(4-methylphenoxy)propan-1-one Traditional Name: (2S)-1-[4-(1,3-benzothiazol-2-yl)piperidino]-2-(4-methylphenoxy)propan-1-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(C)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)O[C@@H](C)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H24N2O2S/c1-15-7-9-18(10-8-15)26-16(2)22(25)24-13-11-17(12-14-24)21-23-19-5-3-4-6-20(19)27-21/h3-10,16-17H,11-14H2,1-2H3/t16-/m0/s1