(2-tert-butyl-5-methyl-4-phenylsulfanyl-pyrazol-3-yl) furan-2-carboxylate

Systemtic Name: (2-tert-butyl-5-methyl-4-phenylsulfanyl-pyrazol-3-yl) furan-2-carboxylate Openeye Name: (2-tert-butyl-5-methyl-4-phenylsulfanyl-pyrazol-3-yl) furan-2-carboxylate CAS Name: 2-furancarboxylic acid [2-tert-butyl-5-methyl-4-(phenylthio)-3-pyrazolyl] ester IUPAC Name: (2-tert-butyl-5-methyl-4-phenylsulfanylpyrazol-3-yl) furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [2-tert-butyl-5-methyl-4-(phenylthio)pyrazol-3-yl] ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1SC2=CC=CC=C2)OC(=O)C3=CC=CO3)C(C)(C)C

Isomeric SMILES

CC1=NN(C(=C1SC2=CC=CC=C2)OC(=O)C3=CC=CO3)C(C)(C)C

InChI

InChI=1S/C19H20N2O3S/c1-13-16(25-14-9-6-5-7-10-14)17(21(20-13)19(2,3)4)24-18(22)15-11-8-12-23-15/h5-12H,1-4H3