2-[bis(thiophen-2-ylmethyl)amino]-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[bis(thiophen-2-ylmethyl)amino]-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[bis(2-thienylmethyl)amino]ethanone CAS Name: 2-[bis(thiophen-2-ylmethyl)amino]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[bis(thiophen-2-ylmethyl)amino]ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[bis(2-thenyl)amino]ethanone Formula: C23H27N3O3S3 MolecularWeight: 489.67378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN(CC2=CC=CS2)CC3=CC=CS3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CN(CC2=CC=CS2)CC3=CC=CS3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O3S3/c27-23(18-24(16-21-8-4-14-30-21)17-22-9-5-15-31-22)25-10-12-26(13-11-25)32(28,29)19-20-6-2-1-3-7-20/h1-9,14-15H,10-13,16-19H2