Vitas-M small molecule compound
(3-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)acetic acid
Catalog ID
STK029470
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2cn(c3c2cccc3)CC(=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 C18H15N3O4S MW 369.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O4S/c1-2-7-21-17(25)13(16(24)19-18(21)26)8-11-9-20(10-15(22)23)14-6-4-3-5-12(11)14/h2-6,8-9H,1,7,10H2,(H,22,23)(H,19,24,26)/b13-8+InChIKey
YIAZGAWIKPYTSV-MDWZMJQESA-NSynonyms
444554-79-4(3((1ALLYL46DIOXO2THIOXOTETRAHYDRO5(2H)PYRIMIDINYLIDENE)METHYL)1HINDOL1YL)ACETICACID
(3((E)(46DIOXO1(PROP2EN1YL)2SULFANYL16DIHYDROPYRIMIDIN5(4H)YLIDENE)METHYL)1HINDOL1YL)ACETICACID
(3((E)(46DIOXO1(PROP2EN1YL)2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)1HINDOL1YL)ACETICACID
(E)2(3((1allyl46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)1Hindol1yl)aceticacid
2(3((E)(46DIOXO1PROP2ENYL2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)INDOL1YL)ACETICACID
444554794
C=CCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)O)C(=O)NC1=S
C=CCN1C(=S)NC(=O)C(=Cc2cn(c3c2cccc3)CC(=O)O)C1=O
InChI=1SC18H15N3O4Sc1272117(25)13(16(24)1918(21)26)811920(1015(22)23)14643512(11)14h2689H1710H2(H2223)(H192426)b138+
MFCD03272908
STK029470
ZINC9010104
Check stock
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Check stock on Vitas-MAvailable files
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