2-[2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]carbonylphenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]carbonylphenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[2-[4-(benzothiophen-3-ylmethyl)piperazine-1-carbonyl]phenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[2-[[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-oxomethyl]phenyl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[2-[4-(1-benzothiophen-3-ylmethyl)piperazine-1-carbonyl]phenyl]sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[2-[4-(benzothiophen-3-ylmethyl)piperazine-1-carbonyl]phenyl]thio]-1-pyrrolidino-ethanone Formula: C26H29N3O2S2 MolecularWeight: 479.65736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)N3CCN(CC3)CC4=CSC5=CC=CC=C54

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)N3CCN(CC3)CC4=CSC5=CC=CC=C54

InChI

InChI=1S/C26H29N3O2S2/c30-25(28-11-5-6-12-28)19-33-24-10-4-2-8-22(24)26(31)29-15-13-27(14-16-29)17-20-18-32-23-9-3-1-7-21(20)23/h1-4,7-10,18H,5-6,11-17,19H2