(4-pyrazol-1-ylphenyl)methyl 2-[(4-methylphenyl)sulfonylamino]ethanoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 2-[(4-methylphenyl)sulfonylamino]ethanoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 2-(p-tolylsulfonylamino)acetate CAS Name: 2-[(4-methylphenyl)sulfonylamino]acetic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 2-[(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-(tosylamino)acetic acid (4-pyrazol-1-ylbenzyl) ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C19H19N3O4S/c1-15-3-9-18(10-4-15)27(24,25)21-13-19(23)26-14-16-5-7-17(8-6-16)22-12-2-11-20-22/h2-12,21H,13-14H2,1H3