(1,3-diphenylpyrazol-4-yl)methyl 2-[(4-methylphenyl)sulfonylamino]ethanoate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl 2-[(4-methylphenyl)sulfonylamino]ethanoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl 2-(p-tolylsulfonylamino)acetate CAS Name: 2-[(4-methylphenyl)sulfonylamino]acetic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl 2-[(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-(tosylamino)acetic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O4S/c1-19-12-14-23(15-13-19)33(30,31)26-16-24(29)32-18-21-17-28(22-10-6-3-7-11-22)27-25(21)20-8-4-2-5-9-20/h2-15,17,26H,16,18H2,1H3