3-bromanyl-4-butoxy-N-[(2,3-dimethylphenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-[(2,3-dimethylphenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[(2,3-dimethylphenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[(2,3-dimethylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[(2,3-dimethylphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[(2,3-dimethylphenyl)thiocarbamoyl]benzamide Formula: C20H23BrN2O2S MolecularWeight: 435.37782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2C)C)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2C)C)Br

InChI

InChI=1S/C20H23BrN2O2S/c1-4-5-11-25-18-10-9-15(12-16(18)21)19(24)23-20(26)22-17-8-6-7-13(2)14(17)3/h6-10,12H,4-5,11H2,1-3H3,(H2,22,23,24,26)