3-bromanyl-4-hexoxy-N-(phenylcarbamothioyl)benzamide

Systemtic Name: 3-bromanyl-4-hexoxy-N-(phenylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-hexoxy-N-(phenylcarbamothioyl)benzamide CAS Name: N-[anilino(sulfanylidene)methyl]-3-bromo-4-hexoxybenzamide IUPAC Name: 3-bromo-4-hexoxy-N-(phenylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-hexoxy-N-(phenylthiocarbamoyl)benzamide Formula: C20H23BrN2O2S MolecularWeight: 435.37782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2)Br

InChI

InChI=1S/C20H23BrN2O2S/c1-2-3-4-8-13-25-18-12-11-15(14-17(18)21)19(24)23-20(26)22-16-9-6-5-7-10-16/h5-7,9-12,14H,2-4,8,13H2,1H3,(H2,22,23,24,26)