N-[(5-iodanylpyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide

Systemtic Name: N-[(5-iodanylpyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide Openeye Name: N-[(5-iodo-2-pyridyl)carbamothioyl]-3-isobutoxy-benzamide CAS Name: N-[[(5-iodo-2-pyridinyl)amino]-sulfanylidenemethyl]-3-(2-methylpropoxy)benzamide IUPAC Name: N-[(5-iodopyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide Traditional Name: N-[(5-iodo-2-pyridyl)thiocarbamoyl]-3-isobutoxy-benzamide Formula: C17H18IN3O2S MolecularWeight: 455.31319

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC=C(C=C2)I

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC=C(C=C2)I

InChI

InChI=1S/C17H18IN3O2S/c1-11(2)10-23-14-5-3-4-12(8-14)16(22)21-17(24)20-15-7-6-13(18)9-19-15/h3-9,11H,10H2,1-2H3,(H2,19,20,21,22,24)