(4-methylsulfanylphenyl)methyl 3-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 3-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: (4-methylsulfanylphenyl)methyl 3-(2-naphthylsulfonylamino)propanoate CAS Name: 3-(2-naphthalenylsulfonylamino)propanoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 3-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-naphthylsulfonylamino)propionic acid [4-(methylthio)benzyl] ester Formula: C21H21NO4S2 MolecularWeight: 415.52574

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)COC(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CSC1=CC=C(C=C1)COC(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H21NO4S2/c1-27-19-9-6-16(7-10-19)15-26-21(23)12-13-22-28(24,25)20-11-8-17-4-2-3-5-18(17)14-20/h2-11,14,22H,12-13,15H2,1H3