2-[4-[2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]ethanoyl]piperazin-1-yl]-N-tert-butyl-ethanamide

Systemtic Name: 2-[4-[2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]ethanoyl]piperazin-1-yl]-N-tert-butyl-ethanamide Openeye Name: 2-[4-[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]acetyl]piperazin-1-yl]-N-tert-butyl-acetamide CAS Name: 2-[4-[2-[(5-bromo-2-thiophenyl)methyl-ethylamino]-1-oxoethyl]-1-piperazinyl]-N-tert-butylacetamide IUPAC Name: 2-[4-[2-[(5-bromothiophen-2-yl)methyl-ethylamino]acetyl]piperazin-1-yl]-N-tert-butylacetamide Traditional Name: 2-[4-[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]acetyl]piperazino]-N-tert-butyl-acetamide Formula: C19H31BrN4O2S MolecularWeight: 459.44404

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Br)CC(=O)N2CCN(CC2)CC(=O)NC(C)(C)C

Isomeric SMILES

CCN(CC1=CC=C(S1)Br)CC(=O)N2CCN(CC2)CC(=O)NC(C)(C)C

InChI

InChI=1S/C19H31BrN4O2S/c1-5-22(12-15-6-7-16(20)27-15)14-18(26)24-10-8-23(9-11-24)13-17(25)21-19(2,3)4/h6-7H,5,8-14H2,1-4H3,(H,21,25)