AC1LE5O7
(E)-2-cyano-3-(4-propan-2-ylphenyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide
Also Known As: (E)-2-cyano-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-(4-isopropylphenyl)acrylamide|(2E)-2-cyano-3-[4-(propan-2-yl)phenyl]-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]prop-2-enamide|(2E)-2-cyano-N-[5-(methylethyl)(1,3,4-thiadiazol-2-yl)]-3-[4-(methylethyl)phen yl]prop-2-enamide|(E)-2-cyano-3-(4-propan-2-ylphenyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide
| Molecular Formula | C18H20N4OS |
|---|---|
| Molecular Weight | 340.13577 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.13577 |
| Monoisotopic Mass | 340.13577 |
| Heavy Atoms | 24 |
| Complexity | 514.0 |
Chemical Identifiers
| CAS Number | 469872-58-0 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NN=C(S2)C(C)C |
| InChIKey | WAPXFPCMZSLYAO-OQLLNIDSSA-N |
Product Overview
AC1LE5O7 (CAS 469872-58-0), with molecular formula C18H20N4OS and molecular weight 340.13577 g/mol. IUPAC: (E)-2-cyano-3-(4-propan-2-ylphenyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide.
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