N-[(5-iodanyl-3-methyl-pyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide

Systemtic Name: N-[(5-iodanyl-3-methyl-pyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide Openeye Name: N-[(5-iodo-3-methyl-2-pyridyl)carbamothioyl]-3-isobutoxy-benzamide CAS Name: N-[[(5-iodo-3-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-3-(2-methylpropoxy)benzamide IUPAC Name: N-[(5-iodo-3-methylpyridin-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide Traditional Name: N-[(5-iodo-3-methyl-2-pyridyl)thiocarbamoyl]-3-isobutoxy-benzamide Formula: C18H20IN3O2S MolecularWeight: 469.33977

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCC(C)C)I

Isomeric SMILES

CC1=CC(=CN=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCC(C)C)I

InChI

InChI=1S/C18H20IN3O2S/c1-11(2)10-24-15-6-4-5-13(8-15)17(23)22-18(25)21-16-12(3)7-14(19)9-20-16/h4-9,11H,10H2,1-3H3,(H2,20,21,22,23,25)