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

Systemtic Name: (2S)-2-cyclohexylsulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)propanamide Openeye Name: (2S)-2-cyclohexylsulfanyl-N-(4-methyl-3-morpholinosulfonyl-phenyl)propanamide CAS Name: (2S)-2-(cyclohexylthio)-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: (2S)-2-cyclohexylsulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: (2S)-2-(cyclohexylthio)-N-(4-methyl-3-morpholinosulfonyl-phenyl)propionamide Formula: C20H30N2O4S2 MolecularWeight: 426.5932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2CCCCC2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](C)SC2CCCCC2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H30N2O4S2/c1-15-8-9-17(14-19(15)28(24,25)22-10-12-26-13-11-22)21-20(23)16(2)27-18-6-4-3-5-7-18/h8-9,14,16,18H,3-7,10-13H2,1-2H3,(H,21,23)/t16-/m0/s1