5-bromanyl-N-(3-methoxypropylcarbamothioyl)-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-(3-methoxypropylcarbamothioyl)-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-(3-methoxypropylcarbamothioyl)-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[(3-methoxypropylamino)-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-(3-methoxypropylcarbamothioyl)-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-(3-methoxypropylthiocarbamoyl)-2-phenethyloxy-benzamide Formula: C20H23BrN2O3S MolecularWeight: 451.37722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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