(2S)-2-(4-acetamidophenyl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: (2S)-2-(4-acetamidophenyl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: (2S)-2-(4-acetamidophenyl)sulfanyl-N-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: (2S)-2-[(4-acetamidophenyl)thio]-N-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: (2S)-2-(4-acetamidophenyl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: (2S)-2-[(4-acetamidophenyl)thio]-N-(4-piperidinosulfonylphenyl)propionamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)SC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)SC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H27N3O4S2/c1-16(30-20-10-6-18(7-11-20)23-17(2)26)22(27)24-19-8-12-21(13-9-19)31(28,29)25-14-4-3-5-15-25/h6-13,16H,3-5,14-15H2,1-2H3,(H,23,26)(H,24,27)/t16-/m0/s1