Vitas-M small molecule compound
3-[(2-hydroxyethyl)sulfanyl]-8,8-dimethyl-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Catalog ID
STL042963
SMILES OCCSc1nnc2n1c(Nc1ccccc1)c(C#N)c1c2COC(C1)(C)C
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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 C20H21N5O2S MW 395.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O2S/c1-20(2)10-14-15(11-21)17(22-13-6-4-3-5-7-13)25-18(16(14)12-27-20)23-24-19(25)28-9-8-26/h3-7,22,26H,8-10,12H2,1-2H3InChIKey
GUROKKHELRLYIA-UHFFFAOYSA-NSynonyms
900880-27-53((2hydroxyethyl)sulfanyl)88dimethyl5(phenylamino)710dihydro8Hpyrano(34c)(124)triazolo(43a)pyridine6carbonitrile
3((2hydroxyethyl)thio)88dimethyl5(phenylamino)810dihydro7Hpyrano(34c)(124)triazolo(43a)pyridine6carbonitrile
900880275
CC1(CC2=C(CO1)C3=NN=C(N3C(=C2C#N)NC4=CC=CC=C4)SCCO)C
InChI=1SC20H21N5O2Sc120(2)101415(1121)17(22136435713)2518(16(14)122720)232419(25)289826h372226H81012H212H3
MFCD06774907
ZINC000005246295
ZINC05246295
ZINC5246295
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