3-bromanyl-N-[(3-butan-2-yloxyphenyl)carbamothioyl]-4-butoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(3-butan-2-yloxyphenyl)carbamothioyl]-4-butoxy-benzamide Openeye Name: 3-bromo-4-butoxy-N-[(3-sec-butoxyphenyl)carbamothioyl]benzamide CAS Name: 3-bromo-N-[(3-butan-2-yloxyanilino)-sulfanylidenemethyl]-4-butoxybenzamide IUPAC Name: 3-bromo-N-[(3-butan-2-yloxyphenyl)carbamothioyl]-4-butoxybenzamide Traditional Name: 3-bromo-4-butoxy-N-[(3-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)C(=O)NC(=S)NC2=CC(=CC=C2)OC(C)CC)Br

Isomeric SMILES

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

InChI

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