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

Systemtic Name: 3-bromanyl-N-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: 3-bromo-N-[(3-chloro-4-fluoro-phenyl)carbamothioyl]-4-isopentyloxy-benzamide CAS Name: 3-bromo-N-[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: 3-bromo-N-[(3-chloro-4-fluorophenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: 3-bromo-N-[(3-chloro-4-fluoro-phenyl)thiocarbamoyl]-4-isoamoxy-benzamide Formula: C19H19BrClFN2O2S MolecularWeight: 473.786763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)F)Cl)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)F)Cl)Br

InChI

InChI=1S/C19H19BrClFN2O2S/c1-11(2)7-8-26-17-6-3-12(9-14(17)20)18(25)24-19(27)23-13-4-5-16(22)15(21)10-13/h3-6,9-11H,7-8H2,1-2H3,(H2,23,24,25,27)