Vitas-M small molecule compound
5-{[1-(5-chloro-2-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK190180
SMILES COc1ccc(cc1n1c(C)cc(c1C)C=C1C(=O)NC(=S)NC1=O)Cl
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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 C18H16ClN3O3S MW 389.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClN3O3S/c1-9-6-11(7-13-16(23)20-18(26)21-17(13)24)10(2)22(9)14-8-12(19)4-5-15(14)25-3/h4-8H,1-3H3,(H2,20,21,23,24,26)InChIKey
XPYFGVQCMCSPHJ-UHFFFAOYSA-NSynonyms
5((1(5CHLORO2METHOXYPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5((1(5CHLORO2METHOXYPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC(=C(N1C2=C(C=CC(=C2)Cl)OC)C)C=C3C(=O)NC(=S)NC3=O
InChI=1SC18H16ClN3O3Sc19611(71316(23)2018(26)2117(13)24)10(2)22(9)14812(19)4515(14)253h48H13H3(H22021232426)
MFCD03711900
ZINC000001163074
ZINC01163074
ZINC1163074
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