AC1LXY25 structure

AC1LXY25

(E)-N-[5-[2-oxo-2-(2-phenoxyethylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide

Also Known As: N-(5-((2-oxo-2-((2-phenoxyethyl)amino)ethyl)thio)-1,3,4-thiadiazol-2-yl)cinnamamide|(2E)-N-[5-({2-oxo-2-[(2-phenoxyethyl)amino]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide|(2E)-N-[(2Z)-5-({2-oxo-2-[(2-phenoxyethyl)amino]ethyl}sulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylprop-2-enamide|(E)-N-[5-[2-oxo-2-(2-phenoxyethylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide|N-[5-(2-phenoxyethylcarbamoylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-prop-2-enamide

CAS: 536985-97-4
Molecular Formula C21H20N4O3S2
Molecular Weight 440.0977 g/mol
LogP 3.4773
Topological Polar Surface Area 93.21 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 7
Rotatable Bonds 10
Exact Mass 440.0977
Monoisotopic Mass 440.0977
Heavy Atoms 30
Complexity 978.18616

Chemical Identifiers

CAS Number 536985-97-4
SMILES C1=CC=C(C=C1)/C=C/C(=O)NC2=NN=C(S2)SCC(=O)NCCOC3=CC=CC=C3

Product Overview

AC1LXY25 (CAS 536985-97-4), with molecular formula C21H20N4O3S2 and molecular weight 440.0977 g/mol. IUPAC: (E)-N-[5-[2-oxo-2-(2-phenoxyethylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide.

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