N-[(2-aminocarbonylphenyl)carbamothioyl]-3-iodanyl-4-methyl-benzamide

Systemtic Name: N-[(2-aminocarbonylphenyl)carbamothioyl]-3-iodanyl-4-methyl-benzamide Openeye Name: N-[(2-carbamoylphenyl)carbamothioyl]-3-iodo-4-methyl-benzamide CAS Name: N-[(2-carbamoylanilino)-sulfanylidenemethyl]-3-iodo-4-methylbenzamide IUPAC Name: N-[(2-carbamoylphenyl)carbamothioyl]-3-iodo-4-methylbenzamide Traditional Name: N-[(2-carbamoylphenyl)thiocarbamoyl]-3-iodo-4-methyl-benzamide Formula: C16H14IN3O2S MolecularWeight: 439.27073

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)N)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)N)I

InChI

InChI=1S/C16H14IN3O2S/c1-9-6-7-10(8-12(9)17)15(22)20-16(23)19-13-5-3-2-4-11(13)14(18)21/h2-8H,1H3,(H2,18,21)(H2,19,20,22,23)