AC1LTMTN
ethyl 2-[[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]-5-phenylthiophene-3-carboxylate
Also Known As: starbld0015377|Ethyl 2-(2-cyano-3-(4-isopropylphenyl)acrylamido)-5-phenylthiophene-3-carboxylate|(E)-ethyl 2-(2-cyano-3-(4-isopropylphenyl)acrylamido)-5-phenylthiophene-3-carboxylate|ethyl 2-({(2E)-2-cyano-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}amino)-5-phenylthiophene-3-carboxylate|ethyl 2-[[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]-5-phenylthiophene-3-carboxylate|ethyl 2-{(2E)-2-cyano-3-[4-(methylethyl)phenyl]prop-2-enoylamino}-5-phenylthio phene-3-carboxylate
| Molecular Formula | C26H24N2O3S |
|---|---|
| Molecular Weight | 444.15076 g/mol |
| LogP | 6.26088 |
| Topological Polar Surface Area | 79.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.15076 |
| Monoisotopic Mass | 444.15076 |
| Heavy Atoms | 32 |
| Complexity | 1170.0311 |
Chemical Identifiers
| CAS Number | 469872-53-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)/C(=C/C3=CC=C(C=C3)C(C)C)/C#N |
Product Overview
AC1LTMTN (CAS 469872-53-5), with molecular formula C26H24N2O3S and molecular weight 444.15076 g/mol. IUPAC: ethyl 2-[[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]-5-phenylthiophene-3-carboxylate.
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