N-[(5-bromanyl-6-methyl-pyridin-2-yl)carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[(5-bromanyl-6-methyl-pyridin-2-yl)carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[(5-bromo-6-methyl-2-pyridyl)carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[(5-bromo-6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[(5-bromo-6-methylpyridin-2-yl)carbamothioyl]-3-propoxybenzamide Traditional Name: N-[(5-bromo-6-methyl-2-pyridyl)thiocarbamoyl]-3-propoxy-benzamide Formula: C17H18BrN3O2S MolecularWeight: 408.31272

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC(=C(C=C2)Br)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC(=C(C=C2)Br)C

InChI

InChI=1S/C17H18BrN3O2S/c1-3-9-23-13-6-4-5-12(10-13)16(22)21-17(24)20-15-8-7-14(18)11(2)19-15/h4-8,10H,3,9H2,1-2H3,(H2,19,20,21,22,24)