N-(4-bromanyl-3-methyl-phenyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[[2-keto-2-(p-toluidino)ethyl]thio]propionamide Formula: C19H21BrN2O2S MolecularWeight: 421.35124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC2=CC(=C(C=C2)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC2=CC(=C(C=C2)Br)C

InChI

InChI=1S/C19H21BrN2O2S/c1-12-4-6-15(7-5-12)21-18(23)11-25-14(3)19(24)22-16-8-9-17(20)13(2)10-16/h4-10,14H,11H2,1-3H3,(H,21,23)(H,22,24)