3-bromanyl-4-hexoxy-N-[(3-hydroxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-hexoxy-N-[(3-hydroxyphenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-hexoxy-N-[(3-hydroxyphenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-hexoxy-N-[(3-hydroxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-hexoxy-N-[(3-hydroxyphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-hexoxy-N-[(3-hydroxyphenyl)thiocarbamoyl]benzamide Formula: C20H23BrN2O3S MolecularWeight: 451.37722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)O)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)O)Br

InChI

InChI=1S/C20H23BrN2O3S/c1-2-3-4-5-11-26-18-10-9-14(12-17(18)21)19(25)23-20(27)22-15-7-6-8-16(24)13-15/h6-10,12-13,24H,2-5,11H2,1H3,(H2,22,23,25,27)