2-azanyl-3-(4-cyanophenyl)-3-methyl-2-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-hexanoic acid

Systemtic Name: 2-azanyl-3-(4-cyanophenyl)-3-methyl-2-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-hexanoic acid Openeye Name: 2-amino-3-(4-cyanophenyl)-3-methyl-2-(2-naphthylsulfonylamino)-4-oxo-hexanoic acid CAS Name: 2-amino-3-(4-cyanophenyl)-3-methyl-2-(2-naphthalenylsulfonylamino)-4-oxohexanoic acid IUPAC Name: 2-amino-3-(4-cyanophenyl)-3-methyl-2-(naphthalen-2-ylsulfonylamino)-4-oxohexanoic acid Traditional Name: 2-amino-3-(4-cyanophenyl)-4-keto-3-methyl-2-(2-naphthylsulfonylamino)hexanoic acid Formula: C24H23N3O5S MolecularWeight: 465.52152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C)(C1=CC=C(C=C1)C#N)C(C(=O)O)(N)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCC(=O)C(C)(C1=CC=C(C=C1)C#N)C(C(=O)O)(N)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C24H23N3O5S/c1-3-21(28)23(2,19-11-8-16(15-25)9-12-19)24(26,22(29)30)27-33(31,32)20-13-10-17-6-4-5-7-18(17)14-20/h4-14,27H,3,26H2,1-2H3,(H,29,30)