4-fluoranyl-N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-fluoranyl-N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]benzamide Openeye Name: 4-fluoro-N-[(3-isopentyloxyphenyl)carbamothioyl]benzamide CAS Name: 4-fluoro-N-[[3-(3-methylbutoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-fluoro-N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]benzamide Traditional Name: 4-fluoro-N-[(3-isoamoxyphenyl)thiocarbamoyl]benzamide Formula: C19H21FN2O2S MolecularWeight: 360.445643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C19H21FN2O2S/c1-13(2)10-11-24-17-5-3-4-16(12-17)21-19(25)22-18(23)14-6-8-15(20)9-7-14/h3-9,12-13H,10-11H2,1-2H3,(H2,21,22,23,25)