2-(phenylmethylsulfanyl)-1-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-(phenylmethylsulfanyl)-1-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-benzylsulfanyl-1-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-1-yl]ethanone CAS Name: 2-(phenylmethylthio)-1-[4-[(2-phenyl-4-thiazolyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-benzylsulfanyl-1-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-(benzylthio)-1-[4-[(2-phenylthiazol-4-yl)methyl]piperazino]ethanone Formula: C23H25N3OS2 MolecularWeight: 423.5941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC(=N2)C3=CC=CC=C3)C(=O)CSCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CSC(=N2)C3=CC=CC=C3)C(=O)CSCC4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS2/c27-22(18-28-16-19-7-3-1-4-8-19)26-13-11-25(12-14-26)15-21-17-29-23(24-21)20-9-5-2-6-10-20/h1-10,17H,11-16,18H2