3-(2-chlorophenyl)-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[(3-iodo-4-methoxy-benzoyl)amino]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[[(3-iodo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[(3-iodo-4-methoxybenzoyl)amino]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[(3-iodo-4-methoxy-benzoyl)amino]thiocarbamoyl]propionamide Formula: C18H17ClIN3O3S MolecularWeight: 517.76835

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2Cl)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2Cl)I

InChI

InChI=1S/C18H17ClIN3O3S/c1-26-15-8-6-12(10-14(15)20)17(25)22-23-18(27)21-16(24)9-7-11-4-2-3-5-13(11)19/h2-6,8,10H,7,9H2,1H3,(H,22,25)(H2,21,23,24,27)