Vitas-M small molecule compound
(5E)-5-[(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-1-(3-methoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL371835
SMILES COc1cccc(c1)N1C(=S)NC(=O)/C(=C\c2cc([nH]c2C)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 C18H17N3O3S MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O3S/c1-10-7-12(11(2)19-10)8-15-16(22)20-18(25)21(17(15)23)13-5-4-6-14(9-13)24-3/h4-9,19H,1-3H3,(H,20,22,25)/b15-8+InChIKey
MHVONWJHALABGZ-OVCLIPMQSA-NSynonyms
(5E)5((25DIMETHYL1HPYRROL3YL)METHYLIDENE)1(3METHOXYPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((25dimethyl1Hpyrrol3yl)methylidene)1(3methoxyphenyl)2thioxodihydropyrimidine46(1H5H)dione
CC1=CC(=C(N1)C)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)OC
COc1cccc(c1)N1C(=S)NC(=O)C(=Cc2cc((nH)c2C)C)C1=O
InChI=1SC18H17N3O3Sc110712(11(2)1910)81516(22)2018(25)21(17(15)23)1354614(913)243h4919H13H3(H202225)b158+
MFCD03145310
ZINC000001151998
ZINC01151998
ZINC1151998
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