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

Systemtic Name: 2-[ethyl(thiophen-2-ylmethyl)amino]-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[ethyl(2-thienylmethyl)amino]ethanone CAS Name: 2-[ethyl(thiophen-2-ylmethyl)amino]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[ethyl(thiophen-2-ylmethyl)amino]ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[ethyl(2-thenyl)amino]ethanone Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CS1)CC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCN(CC1=CC=CS1)CC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H27N3O3S2/c1-2-21(15-19-9-6-14-27-19)16-20(24)22-10-12-23(13-11-22)28(25,26)17-18-7-4-3-5-8-18/h3-9,14H,2,10-13,15-17H2,1H3