5-bromanyl-2-butoxy-N-(heptylcarbamothioyl)benzamide

Systemtic Name: 5-bromanyl-2-butoxy-N-(heptylcarbamothioyl)benzamide Openeye Name: 5-bromo-2-butoxy-N-(heptylcarbamothioyl)benzamide CAS Name: 5-bromo-2-butoxy-N-[(heptylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-butoxy-N-(heptylcarbamothioyl)benzamide Traditional Name: 5-bromo-2-butoxy-N-(heptylthiocarbamoyl)benzamide Formula: C19H29BrN2O2S MolecularWeight: 429.41476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NC(=O)C1=C(C=CC(=C1)Br)OCCCC

Isomeric SMILES

CCCCCCCNC(=S)NC(=O)C1=C(C=CC(=C1)Br)OCCCC

InChI

InChI=1S/C19H29BrN2O2S/c1-3-5-7-8-9-12-21-19(25)22-18(23)16-14-15(20)10-11-17(16)24-13-6-4-2/h10-11,14H,3-9,12-13H2,1-2H3,(H2,21,22,23,25)