5-bromanyl-N-[(4-butan-2-yloxyphenyl)carbamothioyl]-2-butoxy-benzamide

Systemtic Name: 5-bromanyl-N-[(4-butan-2-yloxyphenyl)carbamothioyl]-2-butoxy-benzamide Openeye Name: 5-bromo-2-butoxy-N-[(4-sec-butoxyphenyl)carbamothioyl]benzamide CAS Name: 5-bromo-N-[(4-butan-2-yloxyanilino)-sulfanylidenemethyl]-2-butoxybenzamide IUPAC Name: 5-bromo-N-[(4-butan-2-yloxyphenyl)carbamothioyl]-2-butoxybenzamide Traditional Name: 5-bromo-2-butoxy-N-[(4-sec-butoxyphenyl)thiocarbamoyl]benzamide Formula: C22H27BrN2O3S MolecularWeight: 479.43038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)OC(C)CC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)OC(C)CC

InChI

InChI=1S/C22H27BrN2O3S/c1-4-6-13-27-20-12-7-16(23)14-19(20)21(26)25-22(29)24-17-8-10-18(11-9-17)28-15(3)5-2/h7-12,14-15H,4-6,13H2,1-3H3,(H2,24,25,26,29)