AC1MYO39 structure

AC1MYO39

ethyl 4-[3-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate

Also Known As: Oprea1_701183|AJ-292/13607124|SR-01000451992-1|A2336/0098593|ethyl 4-[3-({2-[(4-chlorophenyl)amino]-2-oxoethyl}thio)-2,5-dioxopyrrolidin-1-yl]benzoate|ETHYL 4-[3-({[(4-CHLOROPHENYL)CARBAMOYL]METHYL}SULFANYL)-2,5-DIOXOPYRROLIDIN-1-YL]BENZOATE|ethyl 4-[3-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-2,5-dioxopyrrolidin-1-yl]benzoate|ethyl 4-(3-((2-((4-chlorophenyl)amino)-2-oxoethyl)thio)-2,5-dioxopyrrolidin-1-yl)benzoate|ethyl 4-(3-{[2-(4-chloroanilino)-2-oxoethyl]thio}-2,5-dioxopyrrolidin-1-yl)benzoate|ethyl 4-[3-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate

CAS: 330864-75-0
Molecular Formula C21H19ClN2O5S
Molecular Weight 446.0703 g/mol
LogP 3.5205
Topological Polar Surface Area 92.78 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 7
Exact Mass 446.0703
Monoisotopic Mass 446.0703
Heavy Atoms 30
Complexity 962.36694

Chemical Identifiers

CAS Number 330864-75-0
SMILES CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)SCC(=O)NC3=CC=C(C=C3)Cl

Product Overview

AC1MYO39 (CAS 330864-75-0), with molecular formula C21H19ClN2O5S and molecular weight 446.0703 g/mol. IUPAC: ethyl 4-[3-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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