(2S)-2-(2-hydroxyethylsulfanyl)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)propanamide

Systemtic Name: (2S)-2-(2-hydroxyethylsulfanyl)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)propanamide Openeye Name: (2S)-2-(2-hydroxyethylsulfanyl)-N-(4-methyl-3-morpholinosulfonyl-phenyl)propanamide CAS Name: (2S)-2-(2-hydroxyethylthio)-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: (2S)-2-(2-hydroxyethylsulfanyl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: (2S)-2-(2-hydroxyethylthio)-N-(4-methyl-3-morpholinosulfonyl-phenyl)propionamide Formula: C16H24N2O5S2 MolecularWeight: 388.50216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SCCO)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](C)SCCO)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C16H24N2O5S2/c1-12-3-4-14(17-16(20)13(2)24-10-7-19)11-15(12)25(21,22)18-5-8-23-9-6-18/h3-4,11,13,19H,5-10H2,1-2H3,(H,17,20)/t13-/m0/s1