About 4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid
4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid (PubChem CID 158737459) has the molecular formula C84H62ClN9O17S4
and a molecular weight of 1633.19 g/mol. Its IUPAC name is 4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid.
Analyze 4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid with MolForge
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Frequently Asked Questions
What is the IUPAC name of 4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid?
The IUPAC name of 4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid (CID 158737459) is 4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid.
What is the SMILES notation for 4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid?
The canonical SMILES for 4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid is CCn1ccc(-c2scc(N(C(=O)CCc3ccccc3)C(=O)CCc3ccccc3)c2C(=O)O)n1.O=C(Cc1csc(-c2ccoc2)c1C(=O)O)c1cc2ccccc2o1.O=C(Cc1csc(-c2ccoc2)c1C(=O)O)c1nc2ccccc2o1.O=C(Nc1csc(-c2cnn(-c3ccc(Cl)cc3)c2)c1C(=O)O)c1cncnc1.
What is the InChIKey of 4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid?
The InChIKey is ILVYHHFPJHISOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H27N3O4S.C19H12ClN5O3S.C19H12O5S.C18H11NO5S/c1-2-30-18-17-22(29-30)27-26(28(34)35)23(19-36-27)31(24(32)15-13-20-9-5-3-6-10-20)25(33)16-14-21-11-7-4-8-12-21;20-13-1-3-14(4-2-13)25-8-12(7-23-25)17-16(19(27)28)15(9-29-17)24-18(26)11-5-21-10-22-6-11;20-14(16-8-11-3-1-2-4-15(11)24-16)7-13-10-25-18(17(13)19(21)22)12-5-6-23-9-12;20-13(17-19-12-3-1-2-4-14(12)24-17)7-11-9-25-16(15(11)18(21)22)10-5-6-23-8-10/h3-12,17-19H,2,13-16H2,1H3,(H,34,35);1-10H,(H,24,26)(H,27,28);1-6,8-10H,7H2,(H,21,22);1-6,8-9H,7H2,(H,21,22).
What are the key properties of 4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid?
4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid has a molecular weight of 1633.19 g/mol, XLogP of 18.60, 25 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-benzofuran-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[2-(1,3-benzoxazol-2-yl)-2-oxoethyl]-2-(furan-3-yl)thiophene-3-carboxylic acid;4-[bis(3-phenylpropanoyl)amino]-2-(1-ethylpyrazol-3-yl)thiophene-3-carboxylic acid;2-[1-(4-chlorophenyl)pyrazol-4-yl]-4-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid is sourced from PubChem (CID 158737459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).