N-ethyl-N-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-ethyl-N-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-ethyl-N-[2-oxo-2-(2-thienylmethylamino)ethyl]acetamide CAS Name: N-ethyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-2-[4-(phenylmethyl)-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-ethyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]acetamide Traditional Name: 2-(4-benzylpiperazino)-N-ethyl-N-[2-keto-2-(2-thenylamino)ethyl]acetamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=CS1)C(=O)CN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCN(CC(=O)NCC1=CC=CS1)C(=O)CN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H30N4O2S/c1-2-26(17-21(27)23-15-20-9-6-14-29-20)22(28)18-25-12-10-24(11-13-25)16-19-7-4-3-5-8-19/h3-9,14H,2,10-13,15-18H2,1H3,(H,23,27)