5-bromanyl-2-ethoxy-N-[(3-heptoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-ethoxy-N-[(3-heptoxyphenyl)carbamothioyl]benzamide Openeye Name: 5-bromo-2-ethoxy-N-[(3-heptoxyphenyl)carbamothioyl]benzamide CAS Name: 5-bromo-2-ethoxy-N-[(3-heptoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-ethoxy-N-[(3-heptoxyphenyl)carbamothioyl]benzamide Traditional Name: 5-bromo-2-ethoxy-N-[(3-heptoxyphenyl)thiocarbamoyl]benzamide Formula: C23H29BrN2O3S MolecularWeight: 493.45696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCC

Isomeric SMILES

CCCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCC

InChI

InChI=1S/C23H29BrN2O3S/c1-3-5-6-7-8-14-29-19-11-9-10-18(16-19)25-23(30)26-22(27)20-15-17(24)12-13-21(20)28-4-2/h9-13,15-16H,3-8,14H2,1-2H3,(H2,25,26,27,30)