Vitas-M small molecule compound
1-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-{[5-(morpholin-4-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK804244
SMILES CCn1c(C)cc(c1C)C(=O)CSc1nnc(n1c1ccccc1)CN1CCOCC1
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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 C23H29N5O2S MW 439.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O2S/c1-4-27-17(2)14-20(18(27)3)21(29)16-31-23-25-24-22(15-26-10-12-30-13-11-26)28(23)19-8-6-5-7-9-19/h5-9,14H,4,10-13,15-16H2,1-3H3InChIKey
CCNRTEYFUKEPMD-UHFFFAOYSA-NSynonyms
938008-67-41(1ethyl25dimethyl1Hpyrrol3yl)2((5(morpholin4ylmethyl)4phenyl4H124triazol3yl)sulfanyl)ethanone
1(1ethyl25dimethyl1Hpyrrol3yl)2((5(morpholinomethyl)4phenyl4H124triazol3yl)thio)ethanone
1(1ethyl25dimethylpyrrol3yl)2((5(morpholin4ylmethyl)4phenyl124triazol3yl)sulfanyl)ethanone
938008674
CCN1C(=CC(=C1C)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)CN4CCOCC4)C
InChI=1SC23H29N5O2Sc142717(2)1420(18(27)3)21(29)163123252422(1526101230131126)28(23)198657919h5914H410131516H213H3
MFCD09156287
ZINC000019852017
ZINC19852017
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