[2-[2-[(5-cyano-2-methoxy-phenyl)sulfonylamino]ethyl]-5-(2-methylsulfonylphenyl)phenyl] 2-azanylbutanoate

Systemtic Name: [2-[2-[(5-cyano-2-methoxy-phenyl)sulfonylamino]ethyl]-5-(2-methylsulfonylphenyl)phenyl] 2-azanylbutanoate Openeye Name: [2-[2-[(5-cyano-2-methoxy-phenyl)sulfonylamino]ethyl]-5-(2-methylsulfonylphenyl)phenyl] 2-aminobutanoate CAS Name: 2-aminobutanoic acid [2-[2-[(5-cyano-2-methoxyphenyl)sulfonylamino]ethyl]-5-(2-methylsulfonylphenyl)phenyl] ester IUPAC Name: [2-[2-[(5-cyano-2-methoxyphenyl)sulfonylamino]ethyl]-5-(2-methylsulfonylphenyl)phenyl] 2-aminobutanoate Traditional Name: 2-aminobutyric acid [2-[2-[(5-cyano-2-methoxy-phenyl)sulfonylamino]ethyl]-5-(2-mesylphenyl)phenyl] ester Formula: C27H29N3O7S2 MolecularWeight: 571.66506

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1=C(C=CC(=C1)C2=CC=CC=C2S(=O)(=O)C)CCNS(=O)(=O)C3=C(C=CC(=C3)C#N)OC)N

Isomeric SMILES

CCC(C(=O)OC1=C(C=CC(=C1)C2=CC=CC=C2S(=O)(=O)C)CCNS(=O)(=O)C3=C(C=CC(=C3)C#N)OC)N

InChI

InChI=1S/C27H29N3O7S2/c1-4-22(29)27(31)37-24-16-20(21-7-5-6-8-25(21)38(3,32)33)11-10-19(24)13-14-30-39(34,35)26-15-18(17-28)9-12-23(26)36-2/h5-12,15-16,22,30H,4,13-14,29H2,1-3H3