N-(4-bromanyl-2-chloranyl-phenyl)-4-ethyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-4-ethyl-piperazine-1-carbothioamide Openeye Name: N-(4-bromo-2-chloro-phenyl)-4-ethyl-piperazine-1-carbothioamide CAS Name: N-(4-bromo-2-chlorophenyl)-4-ethyl-1-piperazinecarbothioamide IUPAC Name: N-(4-bromo-2-chlorophenyl)-4-ethylpiperazine-1-carbothioamide Traditional Name: N-(4-bromo-2-chloro-phenyl)-4-ethyl-piperazine-1-carbothioamide Formula: C13H17BrClN3S MolecularWeight: 362.71618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=S)NC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CCN1CCN(CC1)C(=S)NC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C13H17BrClN3S/c1-2-17-5-7-18(8-6-17)13(19)16-12-4-3-10(14)9-11(12)15/h3-4,9H,2,5-8H2,1H3,(H,16,19)