5-azanyl-2-[1,2-diphenylethyl-(4-ethynylphenyl)sulfonyl-amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[1,2-diphenylethyl-(4-ethynylphenyl)sulfonyl-amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[1,2-diphenylethyl-(4-ethynylphenyl)sulfonyl-amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[1,2-diphenylethyl-(4-ethynylphenyl)sulfonylamino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[1,2-diphenylethyl-(4-ethynylphenyl)sulfonylamino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[1,2-diphenylethyl-(4-ethynylphenyl)sulfonyl-amino]-5-keto-valeric acid Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(C=C1)S(=O)(=O)N(C(CCC(=O)N)C(=O)O)C(CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C#CC1=CC=C(C=C1)S(=O)(=O)N(C(CCC(=O)N)C(=O)O)C(CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H26N2O5S/c1-2-20-13-15-23(16-14-20)35(33,34)29(24(27(31)32)17-18-26(28)30)25(22-11-7-4-8-12-22)19-21-9-5-3-6-10-21/h1,3-16,24-25H,17-19H2,(H2,28,30)(H,31,32)