1-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-methoxyphenyl)sulfonyl-butan-1-one

Systemtic Name: 1-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-methoxyphenyl)sulfonyl-butan-1-one Openeye Name: 1-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-methoxyphenyl)sulfonyl-butan-1-one CAS Name: 1-[4-(4-methoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-4-(4-methoxyphenyl)sulfonyl-1-butanone IUPAC Name: 1-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-methoxyphenyl)sulfonylbutan-1-one Traditional Name: 1-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazino]-4-(4-methoxyphenyl)sulfonyl-butan-1-one Formula: C23H27N3O5S2 MolecularWeight: 489.60758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CCCC(=O)N2CCN(CC2)C3=NC4=C(C=CC=C4S3)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CCCC(=O)N2CCN(CC2)C3=NC4=C(C=CC=C4S3)OC

InChI

InChI=1S/C23H27N3O5S2/c1-30-17-8-10-18(11-9-17)33(28,29)16-4-7-21(27)25-12-14-26(15-13-25)23-24-22-19(31-2)5-3-6-20(22)32-23/h3,5-6,8-11H,4,7,12-16H2,1-2H3