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Home > Encyclopedia > methyl (2E)-2-[(2Z)-2-[1-cyano-2-(4-methylanilino)-2-oxoethylidene]-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]acetate

methyl (2E)-2-[(2Z)-2-[1-cyano-2-(4-methylanilino)-2-oxoethylidene]-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]acetate

methyl (2E)-2-[(2Z)-2-[1-cyano-2-(4-methylanilino)-2-oxoethylidene]-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]acetate structure

methyl (2E)-2-[(2Z)-2-[1-cyano-2-(4-methylanilino)-2-oxoethylidene]-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]acetate 

structure
  • CAS No:

    634164-74-2

  • Formula:

    C22H17N3O4S

  • Chemical Name:

    methyl (2E)-2-[(2Z)-2-[1-cyano-2-(4-methylanilino)-2-oxoethylidene]-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]acetate

  • Synonyms:

    ZINC9075980;STK550812;AKOS005477871;(E)-methyl 2-((Z)-2-(1-cyano-2-oxo-2-(p-tolylamino)ethylidene)-4-oxo-3-phenylthiazolidin-5-ylidene)acetate;634164-74-2;methyl (2E)-[(2Z)-2-{1-cyano-2-[(4-methylphenyl)amino]-2-oxoethylidene}-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]ethanoate

methyl (2E)-2-[(2Z)-2-[1-cyano-2-(4-methylanilino)-2-oxoethylidene]-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]acetate Basic Attributes

419.5 g/mol

419.09397721 g/mol

Characteristics

125 Ų

Computed Properties

Molecular Weight:419.5
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:419.09397721
Monoisotopic Mass:419.09397721
Topological Polar Surface Area:125
Heavy Atom Count:30
Complexity:812
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl (2E)-2-[(2Z)-2-[1-cyano-2-(4-methylanilino)-2-oxoethylidene]-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]acetate

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