N-[4-[3-(methylamino)-2-oxidanyl-propyl]sulfanylphenyl]ethanamide

Systemtic Name: N-[4-[3-(methylamino)-2-oxidanyl-propyl]sulfanylphenyl]ethanamide Openeye Name: N-[4-[2-hydroxy-3-(methylamino)propyl]sulfanylphenyl]acetamide CAS Name: N-[4-[[2-hydroxy-3-(methylamino)propyl]thio]phenyl]acetamide IUPAC Name: N-[4-[2-hydroxy-3-(methylamino)propyl]sulfanylphenyl]acetamide Traditional Name: N-[4-[[2-hydroxy-3-(methylamino)propyl]thio]phenyl]acetamide Formula: C12H18N2O2S MolecularWeight: 254.34852

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC(CNC)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC(CNC)O

InChI

InChI=1S/C12H18N2O2S/c1-9(15)14-10-3-5-12(6-4-10)17-8-11(16)7-13-2/h3-6,11,13,16H,7-8H2,1-2H3,(H,14,15)