[5-azanyl-1-(phenylsulfonyl)pyrazol-3-yl] 4-propan-2-ylbenzoate

Systemtic Name: [5-azanyl-1-(phenylsulfonyl)pyrazol-3-yl] 4-propan-2-ylbenzoate Openeye Name: [5-amino-1-(benzenesulfonyl)pyrazol-3-yl] 4-isopropylbenzoate CAS Name: 4-propan-2-ylbenzoic acid [5-amino-1-(benzenesulfonyl)-3-pyrazolyl] ester IUPAC Name: [5-amino-1-(benzenesulfonyl)pyrazol-3-yl] 4-propan-2-ylbenzoate Traditional Name: 4-isopropylbenzoic acid (5-amino-1-besyl-pyrazol-3-yl) ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)OC2=NN(C(=C2)N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)OC2=NN(C(=C2)N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O4S/c1-13(2)14-8-10-15(11-9-14)19(23)26-18-12-17(20)22(21-18)27(24,25)16-6-4-3-5-7-16/h3-13H,20H2,1-2H3