Vitas-M small molecule compound
methyl (3-{(Z)-[1-(2-ethylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-1-yl)acetate
Catalog ID
STK628233
SMILES COC(=O)Cn1cc(c2c1cccc2)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1CC)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 C24H21N3O4S MW 447.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O4S/c1-3-15-8-4-6-10-19(15)27-23(30)18(22(29)25-24(27)32)12-16-13-26(14-21(28)31-2)20-11-7-5-9-17(16)20/h4-13H,3,14H2,1-2H3,(H,25,29,32)/b18-12-InChIKey
JCVIUKBLFXSSIP-PDGQHHTCSA-NSynonyms
CCC1=CC=CC=C1N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC(=O)OC)C(=O)NC2=S
COC(=O)Cn1cc(c2c1cccc2)C=C1C(=O)N=C(N(C1=O)c1ccccc1CC)S
InChI=1SC24H21N3O4Sc13158461019(15)2723(30)18(22(29)2524(27)32)12161326(1421(28)312)201175917(16)20h413H314H212H3(H252932)b1812
methyl(3((Z)(1(2ethylphenyl)46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)1Hindol1yl)acetate
METHYL2(3((Z)(1(2ETHYLPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)INDOL1YL)ACETATE
MFCD09796870
ZINC000009355023
ZINC09355023
ZINC9355023
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