Vitas-M small molecule compound

(2Z)-2-[2-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)hydrazinylidene]propanoic acid

Catalog ID
STL087622
SMILES OC(=O)/C(=N\Nc1nc2sc3c(c2c(=O)[nH]1)CCCC3)/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 C13H14N4O3S MW 306.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4O3S/c1-6(12(19)20)16-17-13-14-10(18)9-7-4-2-3-5-8(7)21-11(9)15-13/h2-5H2,1H3,(H,19,20)(H2,14,15,17,18)/b16-6-
InChIKey
LCRAMAULHLEZQN-SOFYXZRVSA-N
Synonyms

(2Z)2((4oxo5678tetrahydro3H(1)benzothiolo(23d)pyrimidin2yl)hydrazinylidene)propanoicacid
(2Z)2(2(4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)hydrazinylidene)propanoicacid
CC(=NNC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1)C(=O)O
InChI=1SC13H14N4O3Sc16(12(19)20)1617131410(18)9742358(7)2111(9)1513h25H21H3(H1920)(H214151718)b166
MFCD02601985
OC(=O)C(=NNc1nc2sc3c(c2c(=O)(nH)1)CCCC3)C
ZINC000036632803
ZINC101160146

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Available files

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