3-bromanyl-N-(3-methoxypropylcarbamothioyl)-4-phenethyloxy-benzamide

Systemtic Name: 3-bromanyl-N-(3-methoxypropylcarbamothioyl)-4-phenethyloxy-benzamide Openeye Name: 3-bromo-N-(3-methoxypropylcarbamothioyl)-4-phenethyloxy-benzamide CAS Name: 3-bromo-N-[(3-methoxypropylamino)-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: 3-bromo-N-(3-methoxypropylcarbamothioyl)-4-phenethyloxybenzamide Traditional Name: 3-bromo-N-(3-methoxypropylthiocarbamoyl)-4-phenethyloxy-benzamide Formula: C20H23BrN2O3S MolecularWeight: 451.37722

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NC(=O)C1=CC(=C(C=C1)OCCC2=CC=CC=C2)Br

Isomeric SMILES

COCCCNC(=S)NC(=O)C1=CC(=C(C=C1)OCCC2=CC=CC=C2)Br

InChI

InChI=1S/C20H23BrN2O3S/c1-25-12-5-11-22-20(27)23-19(24)16-8-9-18(17(21)14-16)26-13-10-15-6-3-2-4-7-15/h2-4,6-9,14H,5,10-13H2,1H3,(H2,22,23,24,27)