Vitas-M small molecule compound
(5E)-5-[(1-tert-butyl-1H-pyrrol-2-yl)methylidene]-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL416451
SMILES CN1C(=S)NC(=O)/C(=C\c2cccn2C(C)(C)C)/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 C14H17N3O2S MW 291.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3O2S/c1-14(2,3)17-7-5-6-9(17)8-10-11(18)15-13(20)16(4)12(10)19/h5-8H,1-4H3,(H,15,18,20)/b10-8+InChIKey
CMSOBFGODZYESE-CSKARUKUSA-NSynonyms
(5E)5((1tertbutyl1Hpyrrol2yl)methylidene)1methyl2thioxodihydropyrimidine46(1H5H)dione
(5E)5((1TERTBUTYLPYRROL2YL)METHYLIDENE)1METHYL2SULFANYLIDENE13DIAZINANE46DIONE
5((1TERTBUTYL1HPYRROL2YL)METHYLENE)1METHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CC(C)(C)N1C=CC=C1C=C2C(=O)NC(=S)N(C2=O)C
CN1C(=S)NC(=O)C(=Cc2cccn2C(C)(C)C)C1=O
InChI=1SC14H17N3O2Sc114(23)177569(17)81011(18)1513(20)16(4)12(10)19h58H14H3(H151820)b108+
MFCD03700136
ZINC000100314408
ZINC100314408
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