(2E)-2-(3-Allyl-4-Oxo-1,3-Thiazolidin-2-Ylidene)-N-Methylhydrazinecarbothioamide

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Properties Simple | Detailed

Formula C8H12N4OS2
IUPAC Name 1-[(e)-(3-allyl-4-oxo-thiazolidin-2-ylidene)amino]-3-methyl-thiourea
Molecular Mass 244.337 g·mol−1
Heat of Formation 97.1 ± 16.7 kJ·mol−1
Dipole Moment 5.19 ± 1.08 D
Volume 282.51 Å 3
Surface Area 258.79 Å 2
HOMO Energy -8.33 ± 0.55 eV
LUMO Energy 1.80 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(3-allyl-4-oxothiazolidine-2-ylidene)-4-methylthiosemicarbazone
  • 1-[(3-allyl-4-keto-thiazolidin-2-ylidene)amino]-3-methyl-thiourea
  • 1-[(3-allyl-4-oxo-2-thiazolidinylidene)amino]-3-methylthiourea
  • 1-[(3-allyl-4-oxo-thiazolidin-2-ylidene)amino]-3-methyl-thiourea
  • 3-methyl-1-[(4-oxo-3-prop-2-enyl-1,3-thiazolidin-2-ylidene)amino]thiourea
  • cgp 52608
  • cgp-52608
  • hydrazinecarbothioamide, n-methyl-2-(4-oxo-3-(2-propenyl)-2-thiazolidinylidene)-
CAS Number(s)
  • 87958-67-6
InChIKey DDYJDIHOSRTMSE-DHZHZOJOSA-N
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