1-[4-[4-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[4-[(1,3-benzothiazol-2-ylthio)methyl]benzoyl]piperazino]phenyl]ethanone Formula: C27H25N3O2S2 MolecularWeight: 487.6363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H25N3O2S2/c1-19(31)21-10-12-23(13-11-21)29-14-16-30(17-15-29)26(32)22-8-6-20(7-9-22)18-33-27-28-24-4-2-3-5-25(24)34-27/h2-13H,14-18H2,1H3