(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-N-(2-phenylsulfanylethyl)propanamide

Systemtic Name: (2S)-2-[(4-tert-butylphenyl)sulfonylamino]-N-(2-phenylsulfanylethyl)propanamide Openeye Name: (2S)-2-[(4-tert-butylphenyl)sulfonylamino]-N-(2-phenylsulfanylethyl)propanamide CAS Name: (2S)-2-[(4-tert-butylphenyl)sulfonylamino]-N-[2-(phenylthio)ethyl]propanamide IUPAC Name: (2S)-2-[(4-tert-butylphenyl)sulfonylamino]-N-(2-phenylsulfanylethyl)propanamide Traditional Name: (2S)-2-[(4-tert-butylphenyl)sulfonylamino]-N-[2-(phenylthio)ethyl]propionamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCSC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)NCCSC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H28N2O3S2/c1-16(20(24)22-14-15-27-18-8-6-5-7-9-18)23-28(25,26)19-12-10-17(11-13-19)21(2,3)4/h5-13,16,23H,14-15H2,1-4H3,(H,22,24)/t16-/m0/s1