2-(4-bromanylphenoxy)-N-[[5-[(2S)-butan-2-yl]-2-oxidanyl-phenyl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[[5-[(2S)-butan-2-yl]-2-oxidanyl-phenyl]carbamothioyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[[2-hydroxy-5-[(1S)-1-methylpropyl]phenyl]carbamothioyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[[5-[(2S)-butan-2-yl]-2-hydroxyanilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[[5-[(2S)-butan-2-yl]-2-hydroxyphenyl]carbamothioyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[[2-hydroxy-5-[(1S)-1-methylpropyl]phenyl]thiocarbamoyl]acetamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)COC2=CC=C(C=C2)Br

Isomeric SMILES

CC[C@H](C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C19H21BrN2O3S/c1-3-12(2)13-4-9-17(23)16(10-13)21-19(26)22-18(24)11-25-15-7-5-14(20)6-8-15/h4-10,12,23H,3,11H2,1-2H3,(H2,21,22,24,26)/t12-/m0/s1