4-butoxy-N-[(4-iodanyl-2,5-dimethyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[(4-iodanyl-2,5-dimethyl-phenyl)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[(4-iodo-2,5-dimethyl-phenyl)carbamothioyl]benzamide CAS Name: 4-butoxy-N-[(4-iodo-2,5-dimethylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(4-iodo-2,5-dimethylphenyl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(4-iodo-2,5-dimethyl-phenyl)thiocarbamoyl]benzamide Formula: C20H23IN2O2S MolecularWeight: 482.37829

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23IN2O2S/c1-4-5-10-25-16-8-6-15(7-9-16)19(24)23-20(26)22-18-12-13(2)17(21)11-14(18)3/h6-9,11-12H,4-5,10H2,1-3H3,(H2,22,23,24,26)