N-(2-bromanyl-4-fluoranyl-phenyl)-4-(6-methylpyridin-2-yl)piperazine-1-carbothioamide

Systemtic Name: N-(2-bromanyl-4-fluoranyl-phenyl)-4-(6-methylpyridin-2-yl)piperazine-1-carbothioamide Openeye Name: N-(2-bromo-4-fluoro-phenyl)-4-(6-methyl-2-pyridyl)piperazine-1-carbothioamide CAS Name: N-(2-bromo-4-fluorophenyl)-4-(6-methyl-2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-bromo-4-fluorophenyl)-4-(6-methylpyridin-2-yl)piperazine-1-carbothioamide Traditional Name: N-(2-bromo-4-fluoro-phenyl)-4-(6-methyl-2-pyridyl)piperazine-1-carbothioamide Formula: C17H18BrFN4S MolecularWeight: 409.319023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)N2CCN(CC2)C(=S)NC3=C(C=C(C=C3)F)Br

Isomeric SMILES

CC1=NC(=CC=C1)N2CCN(CC2)C(=S)NC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C17H18BrFN4S/c1-12-3-2-4-16(20-12)22-7-9-23(10-8-22)17(24)21-15-6-5-13(19)11-14(15)18/h2-6,11H,7-10H2,1H3,(H,21,24)