(2S)-2-(4-tert-butylphenyl)sulfanyl-N-(3-morpholin-4-ylsulfonylphenyl)propanamide

Systemtic Name: (2S)-2-(4-tert-butylphenyl)sulfanyl-N-(3-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: (2S)-2-(4-tert-butylphenyl)sulfanyl-N-(3-morpholinosulfonylphenyl)propanamide CAS Name: (2S)-2-[(4-tert-butylphenyl)thio]-N-[3-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: (2S)-2-(4-tert-butylphenyl)sulfanyl-N-(3-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: (2S)-2-[(4-tert-butylphenyl)thio]-N-(3-morpholinosulfonylphenyl)propionamide Formula: C23H30N2O4S2 MolecularWeight: 462.6253

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)SC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)SC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H30N2O4S2/c1-17(30-20-10-8-18(9-11-20)23(2,3)4)22(26)24-19-6-5-7-21(16-19)31(27,28)25-12-14-29-15-13-25/h5-11,16-17H,12-15H2,1-4H3,(H,24,26)/t17-/m0/s1