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(5Z)-3-ethyl-5-({2-[3-(3-methylphenoxy)propoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

(5Z)-3-ethyl-5-({2-[3-(3-methylphenoxy)propoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

Formula: C22H23NO3S2

SMILES: CCN1C(=S)SC(=C/C2=CC=CC=C2OCCCOC2=CC=CC(C)=C2)C1=O

IUPAC: (5Z)-3-ethyl-5-({2-[3-(3-methylphenoxy)propoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

InChI: InChI=1S/C22H23NO3S2/c1-3-23-21(24)20(28-22(23)27)15-17-9-4-5-11-19(17)26-13-7-12-25-18-10-6-8-16(2)14-18/h4-6,8-11,14-15H,3,7,12-13H2,1-2H3/b20-15-

Composition: C (63.90%), H (5.61%), N (3.39%), O (11.61%), S (15.50%)

Molar Mass: 413.55

Atom Count: 51

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 413.111935953
Formal Charge 0
FSP3 0.27
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey AIQUHNLEGRXCFX-HKWRFOASSA-N
Lipinski's Rule of Five
Molar Refractivity 120.78
Topological Polar Surface Area 38.77
Polarizability 46.4
Ring Count 3
Rotatable Bond Count 8

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H23NO3S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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