About 2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide
2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide (PubChem CID 172962072) has the molecular formula C112H101BrCl2N16O17S8
and a molecular weight of 2350.48 g/mol. Its IUPAC name is 2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide.
Frequently Asked Questions
What is the IUPAC name of 2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide?
The IUPAC name of 2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide (CID 172962072) is 2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide.
What is the SMILES notation for 2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide?
The canonical SMILES for 2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide is CNC(=O)c1ccc(CNC(=O)c2ccc(C(=O)N/N=C(\C)c3csc(-c4ccc(Br)cc4)c3O)s2)cc1.CNC(=O)c1ccc(CNC(=O)c2ccc(C(=O)N/N=C(\C)c3csc(-c4ccc(C(C)(C)C)cc4)c3O)s2)cc1.CNC(=O)c1ccc(CNC(=O)c2ccc(C(=O)N/N=C(\C)c3csc(-c4ccc(Cl)c(Cl)c4)c3O)s2)cc1.COc1ccc(-c2scc(/C(C)=N/NC(=O)c3ccc(C(=O)NCc4ccccc4C(N)=O)s3)c2O)cc1.
What is the InChIKey of 2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide?
The InChIKey is WAVGKMAQJAUDHH-SHNWINEJSA-N. The full InChI is InChI=1S/C31H32N4O4S2.C27H23BrN4O4S2.C27H22Cl2N4O4S2.C27H24N4O5S2/c1-18(23-17-40-27(26(23)36)20-10-12-22(13-11-20)31(2,3)4)34-35-30(39)25-15-14-24(41-25)29(38)33-16-19-6-8-21(9-7-19)28(37)32-5;1-15(20-14-37-24(23(20)33)17-7-9-19(28)10-8-17)31-32-27(36)22-12-11-21(38-22)26(35)30-13-16-3-5-18(6-4-16)25(34)29-2;1-14(18-13-38-24(23(18)34)17-7-8-19(28)20(29)11-17)32-33-27(37)22-10-9-21(39-22)26(36)31-12-15-3-5-16(6-4-15)25(35)30-2;1-15(20-14-37-24(23(20)32)16-7-9-18(36-2)10-8-16)30-31-27(35)22-12-11-21(38-22)26(34)29-13-17-5-3-4-6-19(17)25(28)33/h6-15,17,36H,16H2,1-5H3,(H,32,37)(H,33,38)(H,35,39);3-12,14,33H,13H2,1-2H3,(H,29,34)(H,30,35)(H,32,36);3-11,13,34H,12H2,1-2H3,(H,30,35)(H,31,36)(H,33,37);3-12,14,32H,13H2,1-2H3,(H2,28,33)(H,29,34)(H,31,35)/b34-18+;31-15+;32-14+;30-15+.
What are the key properties of 2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide?
2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide has a molecular weight of 2350.48 g/mol, XLogP of 21.62, 33 rotatable bonds, 16 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[(E)-1-[5-(4-bromophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(4-tert-butylphenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide;5-N-[(2-carbamoylphenyl)methyl]-2-N-[(E)-1-[4-hydroxy-5-(4-methoxyphenyl)thiophen-3-yl]ethylideneamino]thiophene-2,5-dicarboxamide;2-N-[(E)-1-[5-(3,4-dichlorophenyl)-4-hydroxythiophen-3-yl]ethylideneamino]-5-N-[[4-(methylcarbamoyl)phenyl]methyl]thiophene-2,5-dicarboxamide is sourced from PubChem (CID 172962072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).