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

Systemtic Name: 3-iodanyl-4-methyl-N-[(phenylmethyl)carbamothioyl]benzamide Openeye Name: N-(benzylcarbamothioyl)-3-iodo-4-methyl-benzamide CAS Name: 3-iodo-4-methyl-N-[[(phenylmethyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-(benzylcarbamothioyl)-3-iodo-4-methylbenzamide Traditional Name: N-(benzylthiocarbamoyl)-3-iodo-4-methyl-benzamide Formula: C16H15IN2OS MolecularWeight: 410.27257

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NCC2=CC=CC=C2)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NCC2=CC=CC=C2)I

InChI

InChI=1S/C16H15IN2OS/c1-11-7-8-13(9-14(11)17)15(20)19-16(21)18-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H2,18,19,20,21)