Vitas-M small molecule compound

(5E)-1-(butan-2-yl)-5-{[(pyridin-3-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione

Catalog ID
STL044660
SMILES CCC(N1C(=NC(=O)/C(=C\NCc2cccnc2)/C1=O)S)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 C15H18N4O2S MW 318.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N4O2S/c1-3-10(2)19-14(21)12(13(20)18-15(19)22)9-17-8-11-5-4-6-16-7-11/h4-7,9-10,17H,3,8H2,1-2H3,(H,18,20,22)/b12-9+
InChIKey
DOANMFWLDTXBBC-FMIVXFBMSA-N
Synonyms

(5E)1(butan2yl)5(((pyridin3ylmethyl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1butan2yl5((pyridin3ylmethylamino)methylidene)2sulfanylidene13diazinane46dione
1SECBUTYL5(1((PYRIDIN3YLMETHYL)AMINO)METH(E)YLIDENE)2THIOXODIHYDROPYRIMIDINE46DIONE
CCC(C)N1C(=O)C(=CNCC2=CN=CC=C2)C(=O)NC1=S
CCC(N1C(=NC(=O)C(=CNCc2cccnc2)C1=O)S)C
InChI=1SC15H18N4O2Sc1310(2)1914(21)12(13(20)1815(19)22)91781154616711h4791017H38H212H3(H182022)b129+
MFCD04074096
ZINC000005817700
ZINC000005817741

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Available files

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