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(2Z,5E)-5-[(3,4-diethoxyphenyl)methylidene]-3-methyl-2-(methylimino)-1,3-thiazolidin-4-one

(2Z,5E)-5-[(3,4-diethoxyphenyl)methylidene]-3-methyl-2-(methylimino)-1,3-thiazolidin-4-one

Formula: C16H20N2O3S

SMILES: CCOC1=CC=C(C=C2SC(=N/C)N(C)C2=O)C=C1OCC

IUPAC: (2Z,5E)-5-[(3,4-diethoxyphenyl)methylidene]-3-methyl-2-(methylimino)-1,3-thiazolidin-4-one

InChI: InChI=1S/C16H20N2O3S/c1-5-20-12-8-7-11(9-13(12)21-6-2)10-14-15(19)18(4)16(17-3)22-14/h7-10H,5-6H2,1-4H3/b14-10+,17-16-

Composition: C (59.98%), H (6.29%), N (8.74%), O (14.98%), S (10.01%)

Molar Mass: 320.41

Atom Count: 42

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 320.119463686
Formal Charge 0
FSP3 0.37
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey FXBJFTJDVTVOPL-CRPPYINASA-N
Lipinski's Rule of Five 1
Molar Refractivity 90.5
Topological Polar Surface Area 51.13
Polarizability 34.16
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H20N2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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