N-[3-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-3-oxidanylidene-1-thiophen-2-yl-propyl]ethanamide

Systemtic Name: N-[3-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-3-oxidanylidene-1-thiophen-2-yl-propyl]ethanamide Openeye Name: N-[3-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-3-oxo-1-(2-thienyl)propyl]acetamide CAS Name: N-[3-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-3-oxo-1-thiophen-2-ylpropyl]acetamide IUPAC Name: N-[3-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-3-oxo-1-thiophen-2-ylpropyl]acetamide Traditional Name: N-[3-[4-(5-bromopyrimidin-2-yl)piperazino]-3-keto-1-(2-thienyl)propyl]acetamide Formula: C17H20BrN5O2S MolecularWeight: 438.342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)N1CCN(CC1)C2=NC=C(C=N2)Br)C3=CC=CS3

Isomeric SMILES

CC(=O)NC(CC(=O)N1CCN(CC1)C2=NC=C(C=N2)Br)C3=CC=CS3

InChI

InChI=1S/C17H20BrN5O2S/c1-12(24)21-14(15-3-2-8-26-15)9-16(25)22-4-6-23(7-5-22)17-19-10-13(18)11-20-17/h2-3,8,10-11,14H,4-7,9H2,1H3,(H,21,24)