(2S)-N-(2-iodanylphenyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide

Systemtic Name: (2S)-N-(2-iodanylphenyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: (2S)-N-(2-iodophenyl)-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanamide CAS Name: (2S)-N-(2-iodophenyl)-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide IUPAC Name: (2S)-N-(2-iodophenyl)-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide Traditional Name: (2S)-N-(2-iodophenyl)-2-[[2-keto-2-(p-toluidino)ethyl]thio]propionamide Formula: C18H19IN2O2S MolecularWeight: 454.32513

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC2=CC=CC=C2I

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CS[C@@H](C)C(=O)NC2=CC=CC=C2I

InChI

InChI=1S/C18H19IN2O2S/c1-12-7-9-14(10-8-12)20-17(22)11-24-13(2)18(23)21-16-6-4-3-5-15(16)19/h3-10,13H,11H2,1-2H3,(H,20,22)(H,21,23)/t13-/m0/s1