3-iodanyl-4-methyl-N-[(4-phenethyloxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-iodanyl-4-methyl-N-[(4-phenethyloxyphenyl)carbamothioyl]benzamide Openeye Name: 3-iodo-4-methyl-N-[(4-phenethyloxyphenyl)carbamothioyl]benzamide CAS Name: 3-iodo-4-methyl-N-[(4-phenethyloxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-iodo-4-methyl-N-[(4-phenethyloxyphenyl)carbamothioyl]benzamide Traditional Name: 3-iodo-4-methyl-N-[(4-phenethyloxyphenyl)thiocarbamoyl]benzamide Formula: C23H21IN2O2S MolecularWeight: 516.39451

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCC3=CC=CC=C3)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCC3=CC=CC=C3)I

InChI

InChI=1S/C23H21IN2O2S/c1-16-7-8-18(15-21(16)24)22(27)26-23(29)25-19-9-11-20(12-10-19)28-14-13-17-5-3-2-4-6-17/h2-12,15H,13-14H2,1H3,(H2,25,26,27,29)