3-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfanyl-N-ethyl-N-(pyridin-4-ylmethyl)propanamide

Systemtic Name: 3-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfanyl-N-ethyl-N-(pyridin-4-ylmethyl)propanamide Openeye Name: 3-(3,5-dichloro-4-hydroxy-phenyl)sulfanyl-N-ethyl-N-(4-pyridylmethyl)propanamide CAS Name: 3-[(3,5-dichloro-4-hydroxyphenyl)thio]-N-ethyl-N-(pyridin-4-ylmethyl)propanamide IUPAC Name: 3-(3,5-dichloro-4-hydroxyphenyl)sulfanyl-N-ethyl-N-(pyridin-4-ylmethyl)propanamide Traditional Name: 3-[(3,5-dichloro-4-hydroxy-phenyl)thio]-N-ethyl-N-(4-pyridylmethyl)propionamide Formula: C17H18Cl2N2O2S MolecularWeight: 385.30802

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C(=O)CCSC2=CC(=C(C(=C2)Cl)O)Cl

Isomeric SMILES

CCN(CC1=CC=NC=C1)C(=O)CCSC2=CC(=C(C(=C2)Cl)O)Cl

InChI

InChI=1S/C17H18Cl2N2O2S/c1-2-21(11-12-3-6-20-7-4-12)16(22)5-8-24-13-9-14(18)17(23)15(19)10-13/h3-4,6-7,9-10,23H,2,5,8,11H2,1H3