4-butoxy-N-[(2-ethyl-4-iodanyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[(2-ethyl-4-iodanyl-phenyl)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[(2-ethyl-4-iodo-phenyl)carbamothioyl]benzamide CAS Name: 4-butoxy-N-[(2-ethyl-4-iodoanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(2-ethyl-4-iodophenyl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(2-ethyl-4-iodo-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)I)CC

Isomeric SMILES

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

InChI

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