iodanylmethane; methyl N-[[2-acetamido-5-(phenylcarbonyl)phenyl]carbamothioyl]carbamate

Systemtic Name: iodanylmethane; methyl N-[[2-acetamido-5-(phenylcarbonyl)phenyl]carbamothioyl]carbamate Openeye Name: iodomethane; methyl N-[(2-acetamido-5-benzoyl-phenyl)carbamothioyl]carbamate CAS Name: N-[(2-acetamido-5-benzoylanilino)-sulfanylidenemethyl]carbamic acid methyl ester; iodomethane IUPAC Name: iodomethane; methyl N-[(2-acetamido-5-benzoylphenyl)carbamothioyl]carbamate Traditional Name: N-[(2-acetamido-5-benzoyl-phenyl)thiocarbamoyl]carbamic acid methyl ester; iodomethane Formula: C19H20IN3O4S MolecularWeight: 513.34927

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)NC(=S)NC(=O)OC.CI

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)NC(=S)NC(=O)OC.CI

InChI

InChI=1S/C18H17N3O4S.CH3I/c1-11(22)19-14-9-8-13(16(23)12-6-4-3-5-7-12)10-15(14)20-17(26)21-18(24)25-2;1-2/h3-10H,1-2H3,(H,19,22)(H2,20,21,24,26);1H3