N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-3-butoxy-benzamide

Systemtic Name: N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-3-butoxy-benzamide Openeye Name: N-[(4-bromo-2,6-dimethyl-phenyl)carbamothioyl]-3-butoxy-benzamide CAS Name: N-[(4-bromo-2,6-dimethylanilino)-sulfanylidenemethyl]-3-butoxybenzamide IUPAC Name: N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]-3-butoxybenzamide Traditional Name: N-[(4-bromo-2,6-dimethyl-phenyl)thiocarbamoyl]-3-butoxy-benzamide Formula: C20H23BrN2O2S MolecularWeight: 435.37782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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