Vitas-M small molecule compound
(5Z)-1-(2-ethylphenyl)-2-sulfanyl-5-[(1,2,5-trimethyl-1H-pyrrol-3-yl)methylidene]pyrimidine-4,6(1H,5H)-dione
Catalog ID
STK615605
SMILES CCc1ccccc1N1C(=NC(=O)/C(=C/c2cc(n(c2C)C)C)/C1=O)S
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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 C20H21N3O2S MW 367.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2S/c1-5-14-8-6-7-9-17(14)23-19(25)16(18(24)21-20(23)26)11-15-10-12(2)22(4)13(15)3/h6-11H,5H2,1-4H3,(H,21,24,26)/b16-11-InChIKey
MBZSPLNEOFNLJF-WJDWOHSUSA-NSynonyms
347379-39-9(5Z)1(2ethylphenyl)2sulfanyl5((125trimethyl1Hpyrrol3yl)methylidene)pyrimidine46(1H5H)dione
(5Z)1(2ETHYLPHENYL)2SULFANYLIDENE5((125TRIMETHYLPYRROL3YL)METHYLIDENE)13DIAZINANE46DIONE
347379399
CCC1=CC=CC=C1N2C(=O)C(=CC3=C(N(C(=C3)C)C)C)C(=O)NC2=S
CCc1ccccc1N1C(=NC(=O)C(=Cc2cc(n(c2C)C)C)C1=O)S
InChI=1SC20H21N3O2Sc1514867917(14)2319(25)16(18(24)2120(23)26)11151012(2)22(4)13(15)3h611H5H214H3(H212426)b1611
MFCD08732001
ZINC000008914513
ZINC08914513
ZINC8914513
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