2-(2-methoxyphenoxy)-1-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(2-methoxyphenoxy)-1-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(2-methoxyphenoxy)-1-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone CAS Name: 2-(2-methoxyphenoxy)-1-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-1-piperazinyl]ethanone IUPAC Name: 2-(2-methoxyphenoxy)-1-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Traditional Name: 1-[4-(4-mesyl-1,3-benzothiazol-2-yl)piperazino]-2-(2-methoxyphenoxy)ethanone Formula: C21H23N3O5S2 MolecularWeight: 461.55442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC(=O)N2CCN(CC2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC=C1OCC(=O)N2CCN(CC2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

InChI

InChI=1S/C21H23N3O5S2/c1-28-15-6-3-4-7-16(15)29-14-19(25)23-10-12-24(13-11-23)21-22-20-17(30-21)8-5-9-18(20)31(2,26)27/h3-9H,10-14H2,1-2H3