3-bromanyl-N-[(3-phenethyloxyphenyl)carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(3-phenethyloxyphenyl)carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[(3-phenethyloxyphenyl)carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[(3-phenethyloxyanilino)-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[(3-phenethyloxyphenyl)carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[(3-phenethyloxyphenyl)thiocarbamoyl]-4-propoxy-benzamide Formula: C25H25BrN2O3S MolecularWeight: 513.4466

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCC3=CC=CC=C3)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCC3=CC=CC=C3)Br

InChI

InChI=1S/C25H25BrN2O3S/c1-2-14-31-23-12-11-19(16-22(23)26)24(29)28-25(32)27-20-9-6-10-21(17-20)30-15-13-18-7-4-3-5-8-18/h3-12,16-17H,2,13-15H2,1H3,(H2,27,28,29,32)