AC1MH8CI structure

AC1MH8CI

N-[4-[4-benzyl-5-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]-2-chlorobenzamide

Also Known As: N-[4-[4-benzyl-5-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]-2-chlorobenzamide|N-{4-[4-benzyl-5-({2-[(2-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}-2-chlorobenzamide|2-(5-{4-[(2-chlorophenyl)carbonylamino]phenyl}-4-benzyl(1,2,4-triazol-3-ylthio ))-N-(2-ethoxyphenyl)acetamide|N-{4-[4-BENZYL-5-({[(2-ETHOXYPHENYL)CARBAMOYL]METHYL}SULFANYL)-1,2,4-TRIAZOL-3-YL]PHENYL}-2-CHLOROBENZAMIDE

CAS: 694501-69-4
Molecular Formula C32H28ClN5O3S
Molecular Weight 597.16016 g/mol
LogP 7.0286
Topological Polar Surface Area 98.14 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 11
Exact Mass 597.16016
Monoisotopic Mass 597.16016
Heavy Atoms 42
Complexity 1675.6632

Chemical Identifiers

CAS Number 694501-69-4
SMILES CCOC1=CC=CC=C1NC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5Cl

Product Overview

AC1MH8CI (CAS 694501-69-4), with molecular formula C32H28ClN5O3S and molecular weight 597.16016 g/mol. IUPAC: N-[4-[4-benzyl-5-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]-2-chlorobenzamide.

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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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