2-[2,4-bis(chloranyl)phenoxy]-N-[(2-ethyl-4-iodanyl-phenyl)carbamothioyl]propanamide

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]-N-[(2-ethyl-4-iodanyl-phenyl)carbamothioyl]propanamide Openeye Name: 2-(2,4-dichlorophenoxy)-N-[(2-ethyl-4-iodo-phenyl)carbamothioyl]propanamide CAS Name: 2-(2,4-dichlorophenoxy)-N-[(2-ethyl-4-iodoanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 2-(2,4-dichlorophenoxy)-N-[(2-ethyl-4-iodophenyl)carbamothioyl]propanamide Traditional Name: 2-(2,4-dichlorophenoxy)-N-[(2-ethyl-4-iodo-phenyl)thiocarbamoyl]propionamide Formula: C18H17Cl2IN2O2S MolecularWeight: 523.21525

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)I)NC(=S)NC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)I)NC(=S)NC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H17Cl2IN2O2S/c1-3-11-8-13(21)5-6-15(11)22-18(26)23-17(24)10(2)25-16-7-4-12(19)9-14(16)20/h4-10H,3H2,1-2H3,(H2,22,23,24,26)