Vitas-M small molecule compound

(2Z)-[(2E)-2-[2-(tert-butoxycarbonyl)hydrazinylidene]-4-oxo-3-(prop-2-en-1-yl)-1,3-thiazolidin-5-ylidene]ethanoic acid

Catalog ID
STK527718
SMILES C=CCN1/C(=N\NC(=O)OC(C)(C)C)/S/C(=C\C(=O)O)/C1=O

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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 C13H17N3O5S MW 327.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O5S/c1-5-6-16-10(19)8(7-9(17)18)22-11(16)14-15-12(20)21-13(2,3)4/h5,7H,1,6H2,2-4H3,(H,15,20)(H,17,18)/b8-7-,14-11+
InChIKey
ADWROWZTLWMSGW-LMEHAKNHSA-N
Synonyms
372504-11-5
(2Z)((2E)2(2(tertbutoxycarbonyl)hydrazinylidene)4oxo3(prop2en1yl)13thiazolidin5ylidene)ethanoicacid
(2Z)2((2E)2((2METHYLPROPAN2YL)OXYCARBONYLHYDRAZINYLIDENE)4OXO3PROP2ENYL13THIAZOLIDIN5YLIDENE)ACETICACID
(3ALLYL2(TERTBUTOXYCARBONYLHYDRAZONO)4OXOTHIAZOLIDIN(5Z)YLIDENE)ACETICACID
(Z)2((E)3allyl2(2(tertbutoxycarbonyl)hydrazono)4oxothiazolidin5ylidene)aceticacid
372504115
C=CCN1C(=NNC(=O)OC(C)(C)C)SC(=CC(=O)O)C1=O
CC(C)(C)OC(=O)NN=C1N(C(=O)C(=CC(=O)O)S1)CC=C
InChI=1SC13H17N3O5Sc1561610(19)8(79(17)18)2211(16)141512(20)2113(23)4h57H16H224H3(H1520)(H1718)b871411+
MFCD01218422
ZINC000001205882
ZINC12381513

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Available files

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