1-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3,3-diphenyl-propan-1-one

Systemtic Name: 1-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3,3-diphenyl-propan-1-one Openeye Name: 1-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3,3-diphenyl-propan-1-one CAS Name: 1-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-3,3-diphenyl-1-propanone IUPAC Name: 1-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3,3-diphenylpropan-1-one Traditional Name: 1-[4-(4-mesyl-1,3-benzothiazol-2-yl)piperazino]-3,3-diphenyl-propan-1-one Formula: C27H27N3O3S2 MolecularWeight: 505.65158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC2=C1N=C(S2)N3CCN(CC3)C(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)C1=CC=CC2=C1N=C(S2)N3CCN(CC3)C(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N3O3S2/c1-35(32,33)24-14-8-13-23-26(24)28-27(34-23)30-17-15-29(16-18-30)25(31)19-22(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-14,22H,15-19H2,1H3