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ZINC00882042,ASN 03572176,N-Ethyl-2-phenoxy-N-(4-phenyl-thiazol-2-yl)-

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摘 要:ZINC00882042,ASN 03572176,N-Ethyl-2-phenoxy-N-(4-phenyl-thiazol-2-yl)-acetamide, N-ethyl-2-(phenoxy)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide,Canonical SMILES: CCN(C1=NC(=CS1)C2=CC=CC=C2)C(=O)COC3=CC=CC=C3,InChI: InChI=1/C19H18N2O2S/c1-2-21(18(22)13-23
[Synonyms]
ZINC00882042
ASN 03572176
N-Ethyl-2-phenoxy-N-(4-phenyl-thiazol-2-yl)-acetamide

[Structure]
ZINC00882042,ASN 03572176,N-Ethyl-2-phenoxy-N-(4-phenyl-thiazol-2-yl)-

[ Properties Computed from Structure]
Molecular Weight338.42342 [g/mol]
Molecular FormulaC19H18N2O2S
XLogP4.1
H-Bond Donor0
H-Bond Acceptor3
Rotatable Bond Count6
Exact Mass338.108899
MonoIsotopic Mass338.108899
Topological Polar Surface Area42.4
Heavy Atom Count24
Formal Charge0
Complexity395
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: N-ethyl-2-(phenoxy)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
Canonical SMILES: CCN(C1=NC(=CS1)C2=CC=CC=C2)C(=O)COC3=CC=CC=C3
InChI: InChI=1/C19H18N2O2S/c1-2-21(18(22)13-23-16-11-7-4-8-12-16)19-20-17(14-
24-19)15-9-5-3-6-10-15/h3-12,14H,2,13H2,1H3

 
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