Vitas-M small molecule compound
5-({1-[2-(3-methoxyphenoxy)ethyl]-1H-indol-3-yl}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK043049
SMILES COc1cccc(c1)OCCn1cc(c2c1cccc2)C=C1C(=O)NC(=S)NC1=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 C22H19N3O4S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O4S/c1-28-15-5-4-6-16(12-15)29-10-9-25-13-14(17-7-2-3-8-19(17)25)11-18-20(26)23-22(30)24-21(18)27/h2-8,11-13H,9-10H2,1H3,(H2,23,24,26,27,30)InChIKey
XZJHAKMEKZPNTL-UHFFFAOYSA-NSynonyms
5((1(2(3METHOXYPHENOXY)ETHYL)1HINDOL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5((1(2(3METHOXYPHENOXY)ETHYL)INDOL3YL)METHYLENE)2THIOXO13DIHYDROPYRIMIDINE46DIONE
5((1(2(3METHOXYPHENOXY)ETHYL)INDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
COC1=CC(=CC=C1)OCCN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=S)NC4=O
COc1cccc(c1)OCCn1cc(c2c1cccc2)C=C1C(=O)NC(=S)NC1=O
InChI=1SC22H19N3O4Sc1281554616(1215)29109251314(17723819(17)25)111820(26)2322(30)2421(18)27h281113H910H21H3(H22324262730)
MFCD02216473
STK043049
ZINC000000813038
ZINC00813038
ZINC813038
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