2-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfanyl-N-methyl-N-(2-pyridin-4-ylethyl)propanamide

Systemtic Name: 2-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfanyl-N-methyl-N-(2-pyridin-4-ylethyl)propanamide Openeye Name: 2-(3,5-dichloro-4-hydroxy-phenyl)sulfanyl-N-methyl-N-[2-(4-pyridyl)ethyl]propanamide CAS Name: 2-[(3,5-dichloro-4-hydroxyphenyl)thio]-N-methyl-N-(2-pyridin-4-ylethyl)propanamide IUPAC Name: 2-(3,5-dichloro-4-hydroxyphenyl)sulfanyl-N-methyl-N-(2-pyridin-4-ylethyl)propanamide Traditional Name: 2-[(3,5-dichloro-4-hydroxy-phenyl)thio]-N-methyl-N-[2-(4-pyridyl)ethyl]propionamide Formula: C17H18Cl2N2O2S MolecularWeight: 385.30802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CCC1=CC=NC=C1)SC2=CC(=C(C(=C2)Cl)O)Cl

Isomeric SMILES

CC(C(=O)N(C)CCC1=CC=NC=C1)SC2=CC(=C(C(=C2)Cl)O)Cl

InChI

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