N-[(5-iodanylpyridin-2-yl)carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[(5-iodanylpyridin-2-yl)carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: N-[(5-iodo-2-pyridyl)carbamothioyl]-4-isopropyl-benzamide CAS Name: N-[[(5-iodo-2-pyridinyl)amino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[(5-iodopyridin-2-yl)carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[(5-iodo-2-pyridyl)thiocarbamoyl]-4-isopropyl-benzamide Formula: C16H16IN3OS MolecularWeight: 425.28721

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16IN3OS/c1-10(2)11-3-5-12(6-4-11)15(21)20-16(22)19-14-8-7-13(17)9-18-14/h3-10H,1-2H3,(H2,18,19,20,21,22)