AC1NZULS

methyl 4-[(E)-[1-[2-(diethylamino)ethyl]-4,5-dioxo-2-thiophen-2-ylpyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Also Known As: 4-[1-(2-Diethylamino-ethyl)-4-hydroxy-5-oxo-2-thiophen-2-yl-2,5-dihydro-1H-pyrrole-3-carbonyl]-3,5-dim ethyl-1H-pyrrole-2-carboxylic acid methyl ester|methyl 4-({1-[2-(diethylamino)ethyl]-4-hydroxy-5-oxo-2-(2-thienyl)(3-pyrrolin- 3-yl)}carbonyl)-3,5-dimethylpyrrole-2-carboxylate|methyl 4-(1-(2-(diethylamino)ethyl)-4-hydroxy-5-oxo-2-(thiophen-2-yl)-2,5-dihydro-1H-pyrrole-3-carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate|methyl 4-[(E)-[1-(2-diethylaminoethyl)-4,5-dioxo-2-thiophen-2-ylpyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate|methyl 4-[(Z)-[1-(2-diethylaminoethyl)-4,5-dioxo-2-thiophen-2-ylpyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Molecular Formula	C23H29N3O5S
Molecular Weight	459.1828 g/mol
LogP	3.24314
Topological Polar Surface Area	102.94 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	459.1828
Monoisotopic Mass	459.1828
Heavy Atoms	32
Complexity	1050.1301

Chemical Identifiers

CAS Number	586992-01-0
SMILES	CCN(CC)CCN1C(/C(=C(/C2=C(NC(=C2C)C(=O)OC)C)\O)/C(=O)C1=O)C3=CC=CS3