1-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2,2-diphenyl-ethanone

Systemtic Name: 1-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2,2-diphenyl-ethanone Openeye Name: 1-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2,2-diphenyl-ethanone CAS Name: 1-[4-(4-methoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-2,2-diphenylethanone IUPAC Name: 1-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2,2-diphenylethanone Traditional Name: 1-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazino]-2,2-diphenyl-ethanone Formula: C26H25N3O2S MolecularWeight: 443.5606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H25N3O2S/c1-31-21-13-8-14-22-24(21)27-26(32-22)29-17-15-28(16-18-29)25(30)23(19-9-4-2-5-10-19)20-11-6-3-7-12-20/h2-14,23H,15-18H2,1H3