N-[(5-bromanyl-6-methyl-pyridin-2-yl)carbamothioyl]-4-butoxy-benzamide

Systemtic Name: N-[(5-bromanyl-6-methyl-pyridin-2-yl)carbamothioyl]-4-butoxy-benzamide Openeye Name: N-[(5-bromo-6-methyl-2-pyridyl)carbamothioyl]-4-butoxy-benzamide CAS Name: N-[[(5-bromo-6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-4-butoxybenzamide IUPAC Name: N-[(5-bromo-6-methylpyridin-2-yl)carbamothioyl]-4-butoxybenzamide Traditional Name: N-[(5-bromo-6-methyl-2-pyridyl)thiocarbamoyl]-4-butoxy-benzamide Formula: C18H20BrN3O2S MolecularWeight: 422.3393

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=C(C=C2)Br)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=C(C=C2)Br)C

InChI

InChI=1S/C18H20BrN3O2S/c1-3-4-11-24-14-7-5-13(6-8-14)17(23)22-18(25)21-16-10-9-15(19)12(2)20-16/h5-10H,3-4,11H2,1-2H3,(H2,20,21,22,23,25)