(5-azanyl-1-naphthalen-2-ylsulfonyl-pyrazol-3-yl) 4-propan-2-ylbenzoate

Systemtic Name: (5-azanyl-1-naphthalen-2-ylsulfonyl-pyrazol-3-yl) 4-propan-2-ylbenzoate Openeye Name: [5-amino-1-(2-naphthylsulfonyl)pyrazol-3-yl] 4-isopropylbenzoate CAS Name: 4-propan-2-ylbenzoic acid [5-amino-1-(2-naphthalenylsulfonyl)-3-pyrazolyl] ester IUPAC Name: (5-amino-1-naphthalen-2-ylsulfonylpyrazol-3-yl) 4-propan-2-ylbenzoate Traditional Name: 4-isopropylbenzoic acid [5-amino-1-(2-naphthylsulfonyl)pyrazol-3-yl] ester Formula: C23H21N3O4S MolecularWeight: 435.49554

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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=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)OC2=NN(C(=C2)N)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H21N3O4S/c1-15(2)16-7-9-18(10-8-16)23(27)30-22-14-21(24)26(25-22)31(28,29)20-12-11-17-5-3-4-6-19(17)13-20/h3-15H,24H2,1-2H3