Vitas-M small molecule compound
3-(butylsulfanyl)-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Catalog ID
STK583567
SMILES CCCCSc1nnc2n1c(Nc1ccc(cc1)C)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 C23H27N5OS MW 421.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5OS/c1-5-6-11-30-22-27-26-21-19-14-29-23(3,4)12-17(19)18(13-24)20(28(21)22)25-16-9-7-15(2)8-10-16/h7-10,25H,5-6,11-12,14H2,1-4H3InChIKey
FDGORRLFKKBIEP-UHFFFAOYSA-NSynonyms
900265-00-13(butylsulfanyl)88dimethyl5((4methylphenyl)amino)710dihydro8Hpyrano(34c)(124)triazolo(43a)pyridine6carbonitrile
3(butylthio)88dimethyl5(ptolylamino)810dihydro7Hpyrano(34c)(124)triazolo(43a)pyridine6carbonitrile
900265001
CCCCSC1=NN=C2N1C(=C(C3=C2COC(C3)(C)C)C#N)NC4=CC=C(C=C4)C
InChI=1SC23H27N5OSc15611302227262119142923(34)1217(19)18(1324)20(28(21)22)25169715(2)81016h71025H56111214H214H3
MFCD06773623
ZINC000005244358
ZINC05244358
ZINC5244358
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