dimethyl-[(2S)-2-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]-2-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(2S)-2-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]-2-phenyl-ethyl]azanium Openeye Name: dimethyl-[(2S)-2-phenyl-2-[3-(p-tolylsulfonylamino)propanoylamino]ethyl]ammonium CAS Name: dimethyl-[(2S)-2-[[3-[(4-methylphenyl)sulfonylamino]-1-oxopropyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2S)-2-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]-2-phenylethyl]azanium Traditional Name: dimethyl-[(2S)-2-phenyl-2-[3-(tosylamino)propanoylamino]ethyl]ammonium Formula: C20H28N3O3S+ MolecularWeight: 390.51962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC(C[NH+](C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N[C@H](C[NH+](C)C)C2=CC=CC=C2

InChI

InChI=1S/C20H27N3O3S/c1-16-9-11-18(12-10-16)27(25,26)21-14-13-20(24)22-19(15-23(2)3)17-7-5-4-6-8-17/h4-12,19,21H,13-15H2,1-3H3,(H,22,24)/p+1/t19-/m1/s1