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(2Z,5E)-5-{[(3-chloro-4-methylphenyl)amino]methylidene}-3-methyl-2-[(2-methyl-1,3-benzothiazol-5-yl)imino]-1,3-thiazolidin-4-one

(2Z,5E)-5-{[(3-chloro-4-methylphenyl)amino]methylidene}-3-methyl-2-[(2-methyl-1,3-benzothiazol-5-yl)imino]-1,3-thiazolidin-4-one

Formula: C20H17ClN4OS2

SMILES: CN1C(SC(=CNC2=CC=C(C)C(Cl)=C2)C1=O)=NC1=CC=C2SC(C)=NC2=C1

IUPAC: (2Z,5E)-5-{[(3-chloro-4-methylphenyl)amino]methylidene}-3-methyl-2-[(2-methyl-1,3-benzothiazol-5-yl)imino]-1,3-thiazolidin-4-one

InChI: InChI=1S/C20H17ClN4OS2/c1-11-4-5-13(8-15(11)21)22-10-18-19(26)25(3)20(28-18)24-14-6-7-17-16(9-14)23-12(2)27-17/h4-10,22H,1-3H3/b18-10+,24-20-

Composition: C (56.00%), H (3.99%), Cl (8.26%), N (13.06%), O (3.73%), S (14.95%)

Molar Mass: 428.95

Atom Count: 45

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 428.0532312
Formal Charge 0
FSP3 0.15
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey GVIKWKVSUOHRSL-KNNUAVEPSA-N
Lipinski's Rule of Five 1
Molar Refractivity 119.42
Topological Polar Surface Area 57.59
Polarizability 44.99
Ring Count 4
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H17ClN4OS2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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