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

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-phenoxy-propan-1-one Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-phenoxy-propan-1-one CAS Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-phenoxy-1-propanone IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-phenoxypropan-1-one Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)piperidino]-2-phenoxy-propan-1-one Formula: C21H22N2O2S MolecularWeight: 366.47658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O2S/c1-15(25-17-9-3-2-4-10-17)21(24)23-13-7-8-16(14-23)20-22-18-11-5-6-12-19(18)26-20/h2-6,9-12,15-16H,7-8,13-14H2,1H3