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2-(4-{[(5Z)-2,4-dioxo-3-(prop-2-yn-1-yl)-1,3-thiazolidin-5-ylidene]methyl}-2-ethoxyphenoxy)acetamide

2-(4-{[(5Z)-2,4-dioxo-3-(prop-2-yn-1-yl)-1,3-thiazolidin-5-ylidene]methyl}-2-ethoxyphenoxy)acetamide

Formula: C17H16N2O5S

SMILES: CCOC1=CC(C=C2/SC(=O)N(CC#C)C2=O)=CC=C1OCC(N)=O

IUPAC: 2-(4-{[(5Z)-2,4-dioxo-3-(prop-2-yn-1-yl)-1,3-thiazolidin-5-ylidene]methyl}-2-ethoxyphenoxy)acetamide

InChI: InChI=1S/C17H16N2O5S/c1-3-7-19-16(21)14(25-17(19)22)9-11-5-6-12(24-10-15(18)20)13(8-11)23-4-2/h1,5-6,8-9H,4,7,10H2,2H3,(H2,18,20)/b14-9-

Composition: C (56.66%), H (4.48%), N (7.77%), O (22.20%), S (8.90%)

Molar Mass: 360.38

Atom Count: 41

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 360.077992797
Formal Charge 0
FSP3 0.24
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey IXHINDGCYKFUAS-ZROIWOOFSA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.28
Topological Polar Surface Area 98.93
Polarizability 35.54
Ring Count 2
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 C17H16N2O5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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