2-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]-N-(3-chloranyl-4-cyano-phenyl)ethanamide

Systemtic Name: 2-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]-N-(3-chloranyl-4-cyano-phenyl)ethanamide Openeye Name: 2-[4-[(5-bromo-2-thienyl)methyl]piperazin-1-yl]-N-(3-chloro-4-cyano-phenyl)acetamide CAS Name: 2-[4-[(5-bromo-2-thiophenyl)methyl]-1-piperazinyl]-N-(3-chloro-4-cyanophenyl)acetamide IUPAC Name: 2-[4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl]-N-(3-chloro-4-cyanophenyl)acetamide Traditional Name: 2-[4-[(5-bromo-2-thienyl)methyl]piperazino]-N-(3-chloro-4-cyano-phenyl)acetamide Formula: C18H18BrClN4OS MolecularWeight: 453.78372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)Br)CC(=O)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)Br)CC(=O)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H18BrClN4OS/c19-17-4-3-15(26-17)11-23-5-7-24(8-6-23)12-18(25)22-14-2-1-13(10-21)16(20)9-14/h1-4,9H,5-8,11-12H2,(H,22,25)