3-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-pyrazol-1-yl]thiophene-2-carboxylic acid

Systemtic Name: 3-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-pyrazol-1-yl]thiophene-2-carboxylic acid Openeye Name: 3-[5-(tert-butoxycarbonylamino)-3-phenyl-pyrazol-1-yl]thiophene-2-carboxylic acid CAS Name: 3-[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenyl-1-pyrazolyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpyrazol-1-yl]thiophene-2-carboxylic acid Traditional Name: 3-[5-(tert-butoxycarbonylamino)-3-phenyl-pyrazol-1-yl]-2-thenoic acid Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=NN1C2=C(SC=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=NN1C2=C(SC=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O4S/c1-19(2,3)26-18(25)20-15-11-13(12-7-5-4-6-8-12)21-22(15)14-9-10-27-16(14)17(23)24/h4-11H,1-3H3,(H,20,25)(H,23,24)