Vitas-M small molecule compound
2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethanone
Catalog ID
STK697435
SMILES COCCn1c(C)cc(c1C)C(=O)CSc1nnc(n1CC)c1ccc(cc1)OC
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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 C22H28N4O3S MW 428.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O3S/c1-6-25-21(17-7-9-18(29-5)10-8-17)23-24-22(25)30-14-20(27)19-13-15(2)26(16(19)3)11-12-28-4/h7-10,13H,6,11-12,14H2,1-5H3InChIKey
SZLSKBCWQHKCEA-UHFFFAOYSA-NSynonyms
929823-30-32((4ethyl5(4methoxyphenyl)124triazol3yl)sulfanyl)1(1(2methoxyethyl)25dimethylpyrrol3yl)ethanone
2((4ethyl5(4methoxyphenyl)4H124triazol3yl)sulfanyl)1(1(2methoxyethyl)25dimethyl1Hpyrrol3yl)ethanone
2((4ethyl5(4methoxyphenyl)4H124triazol3yl)thio)1(1(2methoxyethyl)25dimethyl1Hpyrrol3yl)ethanone
929823303
CCN1C(=NN=C1SCC(=O)C2=C(N(C(=C2)C)CCOC)C)C3=CC=C(C=C3)OC
InChI=1SC22H28N4O3Sc162521(177918(295)10817)232422(25)301420(27)191315(2)26(16(19)3)1112284h71013H6111214H215H3
MFCD04934012
ZINC000009531016
ZINC09531016
ZINC9531016
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