5-bromanyl-N-(4-methylpiperazin-1-yl)carbothioyl-pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-(4-methylpiperazin-1-yl)carbothioyl-pyridine-3-carboxamide Openeye Name: 5-bromo-N-(4-methylpiperazine-1-carbothioyl)pyridine-3-carboxamide CAS Name: 5-bromo-N-[(4-methyl-1-piperazinyl)-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-(4-methylpiperazine-1-carbothioyl)pyridine-3-carboxamide Traditional Name: 5-bromo-N-(4-methylpiperazine-1-carbothioyl)nicotinamide Formula: C12H15BrN4OS MolecularWeight: 343.2427

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CN1CCN(CC1)C(=S)NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C12H15BrN4OS/c1-16-2-4-17(5-3-16)12(19)15-11(18)9-6-10(13)8-14-7-9/h6-8H,2-5H2,1H3,(H,15,18,19)