(2R)-1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-phenoxy-butan-1-one

Systemtic Name: (2R)-1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-phenoxy-butan-1-one Openeye Name: (2R)-1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-phenoxy-butan-1-one CAS Name: (2R)-1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-phenoxy-1-butanone IUPAC Name: (2R)-1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-phenoxybutan-1-one Traditional Name: (2R)-1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-2-phenoxy-butan-1-one Formula: C22H24N2O2S MolecularWeight: 380.50316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCCC(C1)C2=NC3=CC=CC=C3S2)OC4=CC=CC=C4

Isomeric SMILES

CC[C@H](C(=O)N1CCC[C@H](C1)C2=NC3=CC=CC=C3S2)OC4=CC=CC=C4

InChI

InChI=1S/C22H24N2O2S/c1-2-19(26-17-10-4-3-5-11-17)22(25)24-14-8-9-16(15-24)21-23-18-12-6-7-13-20(18)27-21/h3-7,10-13,16,19H,2,8-9,14-15H2,1H3/t16-,19-/m1/s1