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(5Z)-5-({5-chloro-2-[2-(4-ethylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

(5Z)-5-({5-chloro-2-[2-(4-ethylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

Formula: C20H18ClNO3S2

SMILES: CCC1=CC=C(OCCOC2=CC=C(Cl)C=C2C=C2/SC(=S)NC2=O)C=C1

IUPAC: (5Z)-5-({5-chloro-2-[2-(4-ethylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

InChI: InChI=1S/C20H18ClNO3S2/c1-2-13-3-6-16(7-4-13)24-9-10-25-17-8-5-15(21)11-14(17)12-18-19(23)22-20(26)27-18/h3-8,11-12H,2,9-10H2,1H3,(H,22,23,26)/b18-12-

Composition: C (57.20%), H (4.32%), Cl (8.44%), N (3.34%), O (11.43%), S (15.27%)

Molar Mass: 419.94

Atom Count: 45

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 419.0416635
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey AYHLTEQPONECSG-PDGQHHTCSA-N
Lipinski's Rule of Five
Molar Refractivity 115.67
Topological Polar Surface Area 47.56
Polarizability 44.57
Ring Count 3
Rotatable Bond Count 7

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H18ClNO3S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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