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

Systemtic Name: (3R)-1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-phenyl-butan-1-one Openeye Name: (3R)-1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-phenyl-butan-1-one CAS Name: (3R)-1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-phenyl-1-butanone IUPAC Name: (3R)-1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-phenylbutan-1-one Traditional Name: (3R)-1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-3-phenyl-butan-1-one Formula: C22H24N2OS MolecularWeight: 364.50376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCCC(C1)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2OS/c1-16(17-8-3-2-4-9-17)14-21(25)24-13-7-10-18(15-24)22-23-19-11-5-6-12-20(19)26-22/h2-6,8-9,11-12,16,18H,7,10,13-15H2,1H3/t16-,18-/m1/s1