N-[4-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoylamino]phenyl]-2-methyl-propanamide

Systemtic Name: N-[4-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoylamino]phenyl]-2-methyl-propanamide Openeye Name: N-[4-[[2-(4-bromo-2-methyl-phenyl)sulfanylacetyl]amino]phenyl]-2-methyl-propanamide CAS Name: N-[4-[[2-[(4-bromo-2-methylphenyl)thio]-1-oxoethyl]amino]phenyl]-2-methylpropanamide IUPAC Name: N-[4-[[2-(4-bromo-2-methylphenyl)sulfanylacetyl]amino]phenyl]-2-methylpropanamide Traditional Name: N-[4-[[2-[(4-bromo-2-methyl-phenyl)thio]acetyl]amino]phenyl]-2-methyl-propionamide Formula: C19H21BrN2O2S MolecularWeight: 421.35124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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