AC1MJS8Z
2-[[5-cyano-4-(4-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-phenylacetamide
Also Known As: Oprea1_361905|Oprea1_630040|BAS 02589934|2-((3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl)thio)-N-phenylacetamide|2-[[5-cyano-4-(4-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-phenylacetamide|AG-205/37159070|SR-01000420128-1|F0291-0007|A1931/0081284|2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-phenylacetamide|2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydro-2-pyridinyl]sulfanyl}-N-phenylacetamide
| Molecular Formula | C22H21N3O3S |
|---|---|
| Molecular Weight | 407.13037 g/mol |
| LogP | 3.79588 |
| Topological Polar Surface Area | 91.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 407.13037 |
| Monoisotopic Mass | 407.13037 |
| Heavy Atoms | 29 |
| Complexity | 949.5178 |
Chemical Identifiers
| CAS Number | 328071-36-9 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC=CC=C3 |
Product Overview
AC1MJS8Z (CAS 328071-36-9), with molecular formula C22H21N3O3S and molecular weight 407.13037 g/mol. IUPAC: 2-[[5-cyano-4-(4-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-phenylacetamide.
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