N-[(4-tert-butylphenyl)methyl]-2-[3-cyano-4-(methylsulfonylamino)phenyl]propanamide

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-2-[3-cyano-4-(methylsulfonylamino)phenyl]propanamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-2-[3-cyano-4-(methanesulfonamido)phenyl]propanamide CAS Name: N-[(4-tert-butylphenyl)methyl]-2-[3-cyano-4-(methanesulfonamido)phenyl]propanamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-2-[3-cyano-4-(methanesulfonamido)phenyl]propanamide Traditional Name: N-(4-tert-butylbenzyl)-2-[3-cyano-4-(methanesulfonamido)phenyl]propionamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)NS(=O)(=O)C)C#N)C(=O)NCC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C1=CC(=C(C=C1)NS(=O)(=O)C)C#N)C(=O)NCC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H27N3O3S/c1-15(17-8-11-20(18(12-17)13-23)25-29(5,27)28)21(26)24-14-16-6-9-19(10-7-16)22(2,3)4/h6-12,15,25H,14H2,1-5H3,(H,24,26)