Oprea1_096869 structure

Oprea1_096869

1-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea

Also Known As: Oprea1_096869|N-(5-{[(4-chlorobenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2-yl)-N'-(4-ethoxyphenyl)urea|AO-022/43453452|1-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea|1-(5-(((4-chlorobenzyl)thio)methyl)-1,3,4-thiadiazol-2-yl)-3-(4-ethoxyphenyl)urea|3-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]-1-(4-ethoxyphenyl)urea|1-[(2E)-5-{[(4-chlorobenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-ethoxyphenyl)urea|3-[5-({[(4-chlorophenyl)methyl]sulfanyl}methyl)-1,3,4-thiadiazol-2-yl]-1-(4-ethoxyphenyl)urea

CAS: 426249-99-2
Molecular Formula C19H19ClN4O2S2
Molecular Weight 434.06378 g/mol
LogP 5.6676
Topological Polar Surface Area 76.14 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 8
Exact Mass 434.06378
Monoisotopic Mass 434.06378
Heavy Atoms 28
Complexity 901.0569

Chemical Identifiers

CAS Number 426249-99-2
SMILES CCOC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CSCC3=CC=C(C=C3)Cl

Product Overview

Oprea1_096869 (CAS 426249-99-2), with molecular formula C19H19ClN4O2S2 and molecular weight 434.06378 g/mol. IUPAC: 1-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea.

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