3-bromanyl-4-butoxy-N-(heptylcarbamothioyl)benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-(heptylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-butoxy-N-(heptylcarbamothioyl)benzamide CAS Name: 3-bromo-4-butoxy-N-[(heptylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-(heptylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-butoxy-N-(heptylthiocarbamoyl)benzamide Formula: C19H29BrN2O2S MolecularWeight: 429.41476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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