(2-oxidanylidene-1,2-diphenyl-ethyl) 4-[methylsulfonyl-(1,3,5-trimethylpyrazol-4-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 4-[methylsulfonyl-(1,3,5-trimethylpyrazol-4-yl)amino]-4-oxidanylidene-butanoate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 4-[methylsulfonyl-(1,3,5-trimethylpyrazol-4-yl)amino]-4-oxo-butanoate CAS Name: 4-[methylsulfonyl-(1,3,5-trimethyl-4-pyrazolyl)amino]-4-oxobutanoic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 4-[methylsulfonyl-(1,3,5-trimethylpyrazol-4-yl)amino]-4-oxobutanoate Traditional Name: 4-keto-4-[mesyl-(1,3,5-trimethylpyrazol-4-yl)amino]butyric acid desyl ester Formula: C25H27N3O6S MolecularWeight: 497.56338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)N(C(=O)CCC(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NN1C)C)N(C(=O)CCC(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C25H27N3O6S/c1-17-23(18(2)27(3)26-17)28(35(4,32)33)21(29)15-16-22(30)34-25(20-13-9-6-10-14-20)24(31)19-11-7-5-8-12-19/h5-14,25H,15-16H2,1-4H3