3-iodanyl-4-methyl-N-[(phenylcarbamoylamino)carbamothioyl]benzamide

Systemtic Name: 3-iodanyl-4-methyl-N-[(phenylcarbamoylamino)carbamothioyl]benzamide Openeye Name: 3-iodo-4-methyl-N-[(phenylcarbamoylamino)carbamothioyl]benzamide CAS Name: N-[[[anilino(oxo)methyl]hydrazo]-sulfanylidenemethyl]-3-iodo-4-methylbenzamide IUPAC Name: 3-iodo-4-methyl-N-[(phenylcarbamoylamino)carbamothioyl]benzamide Traditional Name: 3-iodo-4-methyl-N-[(phenylcarbamoylamino)thiocarbamoyl]benzamide Formula: C16H15IN4O2S MolecularWeight: 454.28537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)NC2=CC=CC=C2)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)NC2=CC=CC=C2)I

InChI

InChI=1S/C16H15IN4O2S/c1-10-7-8-11(9-13(10)17)14(22)19-16(24)21-20-15(23)18-12-5-3-2-4-6-12/h2-9H,1H3,(H2,18,20,23)(H2,19,21,22,24)