Vitas-M small molecule compound
2-{[4-ethyl-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[1-(4-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethanone
Catalog ID
STK336284
SMILES CCc1ccc(cc1)n1c(C)cc(c1C)C(=O)CSc1nnc(n1CC)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 C25H33N5O2S MW 467.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N5O2S/c1-5-20-7-9-21(10-8-20)30-18(3)15-22(19(30)4)23(31)17-33-25-27-26-24(29(25)6-2)16-28-11-13-32-14-12-28/h7-10,15H,5-6,11-14,16-17H2,1-4H3InChIKey
RNSCEKFSEIVVHF-UHFFFAOYSA-NSynonyms
2((4ethyl5(morpholin4ylmethyl)124triazol3yl)sulfanyl)1(1(4ethylphenyl)25dimethylpyrrol3yl)ethanone
2((4ethyl5(morpholin4ylmethyl)4H124triazol3yl)sulfanyl)1(1(4ethylphenyl)25dimethyl1Hpyrrol3yl)ethanone
CCC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)CSC3=NN=C(N3CC)CN4CCOCC4)C
InChI=1SC25H33N5O2Sc15207921(10820)3018(3)1522(19(30)4)23(31)173325272624(29(25)62)1628111332141228h71015H5611141617H214H3
MFCD09964651
ZINC000015019458
ZINC15019458
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