2-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylphenyl]-3-phenethyl-1,3-thiazolidin-4-one

Systemtic Name: 2-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylphenyl]-3-phenethyl-1,3-thiazolidin-4-one Openeye Name: 2-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]phenyl]-3-phenethyl-thiazolidin-4-one CAS Name: 2-[4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]phenyl]-3-phenethyl-4-thiazolidinone IUPAC Name: 2-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]phenyl]-3-phenethyl-1,3-thiazolidin-4-one Traditional Name: 3-phenethyl-2-[4-(4-piperonylpiperazine-1-carbonyl)phenyl]thiazolidin-4-one Formula: C30H31N3O4S MolecularWeight: 529.64984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)C5N(C(=O)CS5)CCC6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)C5N(C(=O)CS5)CCC6=CC=CC=C6

InChI

InChI=1S/C30H31N3O4S/c34-28-20-38-30(33(28)13-12-22-4-2-1-3-5-22)25-9-7-24(8-10-25)29(35)32-16-14-31(15-17-32)19-23-6-11-26-27(18-23)37-21-36-26/h1-11,18,30H,12-17,19-21H2