Vitas-M small molecule compound

(5Z)-1-(1,3-benzodioxol-5-yl)-5-(thiophen-2-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK176790
SMILES O=C1NC(=O)/C(=C/c2cccs2)/C(=O)N1c1ccc2c(c1)OCO2

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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 C16H10N2O5S MW 342.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N2O5S/c19-14-11(7-10-2-1-5-24-10)15(20)18(16(21)17-14)9-3-4-12-13(6-9)23-8-22-12/h1-7H,8H2,(H,17,19,21)/b11-7-
InChIKey
KJZKBSOEYAJTRZ-XFFZJAGNSA-N
Synonyms

(5Z)1(13BENZODIOXOL5YL)5(THIOPHEN2YLMETHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(13BENZODIOXOL5YL)5(THIOPHEN2YLMETHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
C1OC2=C(O1)C=C(C=C2)N3C(=O)C(=CC4=CC=CS4)C(=O)NC3=O
InChI=1SC16H10N2O5Sc191411(7102152410)15(20)18(16(21)1714)9341213(69)2382212h17H8H2(H171921)b117
MFCD02628972
O=C1NC(=O)C(=Cc2cccs2)C(=O)N1c1ccc2c(c1)OCO2
ZINC000000308808
ZINC00308808
ZINC308808

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Available files

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