N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]-4-fluoranyl-benzamide

Systemtic Name: N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]-4-fluoranyl-benzamide Openeye Name: 4-fluoro-N-[(2-hydroxy-5-sec-butyl-phenyl)carbamothioyl]benzamide CAS Name: N-[(5-butan-2-yl-2-hydroxyanilino)-sulfanylidenemethyl]-4-fluorobenzamide IUPAC Name: N-[(5-butan-2-yl-2-hydroxyphenyl)carbamothioyl]-4-fluorobenzamide Traditional Name: 4-fluoro-N-[(2-hydroxy-5-sec-butyl-phenyl)thiocarbamoyl]benzamide Formula: C18H19FN2O2S MolecularWeight: 346.419063

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H19FN2O2S/c1-3-11(2)13-6-9-16(22)15(10-13)20-18(24)21-17(23)12-4-7-14(19)8-5-12/h4-11,22H,3H2,1-2H3,(H2,20,21,23,24)