5-bromanyl-N-[(3,4,5-trimethoxyphenyl)carbamothioyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[(3,4,5-trimethoxyphenyl)carbamothioyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(3,4,5-trimethoxyphenyl)carbamothioyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[sulfanylidene-(3,4,5-trimethoxyanilino)methyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(3,4,5-trimethoxyphenyl)carbamothioyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(3,4,5-trimethoxyphenyl)thiocarbamoyl]nicotinamide Formula: C16H16BrN3O4S MolecularWeight: 426.28494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C16H16BrN3O4S/c1-22-12-5-11(6-13(23-2)14(12)24-3)19-16(25)20-15(21)9-4-10(17)8-18-7-9/h4-8H,1-3H3,(H2,19,20,21,25)