AC1M2ZB0
methyl (4Z)-2-methyl-1-(2-methylpropyl)-5-oxo-4-(thiophen-2-ylmethylidene)pyrrole-3-carboxylate
Also Known As: BIM-0036253.P001|AG-205/12669108|SR-01000523936-1|methyl 1-isobutyl-2-methyl-5-oxo-4-(2-thienylmethylene)-4,5-dihydro-1H-pyrrole-3-carboxylate|A1988/0083612|methyl 5-methyl-1-(2-methylpropyl)-2-oxo-3-(2-thienylmethylene)azoline-4-carbo xylate|methyl (4Z)-2-methyl-1-(2-methylpropyl)-5-oxo-4-(thiophen-2-ylmethylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate|methyl (4Z)-2-methyl-1-(2-methylpropyl)-5-oxo-4-(thiophen-2-ylmethylidene)pyrrole-3-carboxylate|METHYL (4Z)-2-METHYL-1-(2-METHYLPROPYL)-5-OXO-4-[(THIOPHEN-2-YL)METHYLIDENE]-4,5-DIHYDRO-1H-PYRROLE-3-CARBOXYLATE
| Molecular Formula | C16H19NO3S |
|---|---|
| Molecular Weight | 305.10855 g/mol |
| LogP | 3.0767 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.10855 |
| Monoisotopic Mass | 305.10855 |
| Heavy Atoms | 21 |
| Complexity | 611.47644 |
Chemical Identifiers
| CAS Number | 5896-33-3 |
|---|---|
| SMILES | CC1=C(/C(=C/C2=CC=CS2)/C(=O)N1CC(C)C)C(=O)OC |
Product Overview
AC1M2ZB0 (CAS 5896-33-3), with molecular formula C16H19NO3S and molecular weight 305.10855 g/mol. IUPAC: methyl (4Z)-2-methyl-1-(2-methylpropyl)-5-oxo-4-(thiophen-2-ylmethylidene)pyrrole-3-carboxylate.
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