Vitas-M small molecule compound

(2E)-2-[1-(5-methyl-2-oxo-3-propanoyltetrahydrofuran-3-yl)propan-2-ylidene]hydrazinecarbothioamide

Catalog ID
STL047892
SMILES CCC(=O)C1(CC(OC1=O)C)C/C(=N/NC(=S)N)/C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H19N3O3S MW 285.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H19N3O3S/c1-4-9(16)12(6-8(3)18-10(12)17)5-7(2)14-15-11(13)19/h8H,4-6H2,1-3H3,(H3,13,15,19)/b14-7+
InChIKey
UTRSVPWJBCFRNU-VGOFMYFVSA-N
Synonyms
844652-89-7
((E)1(5methyl2oxo3propanoyloxolan3yl)propan2ylideneamino)thiourea
(2E)2(1(5methyl2oxo3propanoyltetrahydrofuran3yl)propan2ylidene)hydrazinecarbothioamide
(E)2(1(5methyl2oxo3propionyltetrahydrofuran3yl)propan2ylidene)hydrazinecarbothioamide
844652897
CCC(=O)C1(CC(OC1=O)C)CC(=NNC(=S)N)C
InChI=1SC12H19N3O3Sc149(16)12(68(3)1810(12)17)57(2)141511(13)19h8H46H213H3(H3131519)b147+
MFCD04159249
ZINC000000534689
ZINC000005441992

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Available files

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