Vitas-M small molecule compound
N-benzyl-2-({6-cyano-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamide
Catalog ID
STK585286
SMILES N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)NCc3ccccc3)nnc2c2c1CC(C)(C)OC2
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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 C28H28N6O2S MW 512.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N6O2S/c1-18-9-11-20(12-10-18)31-25-22(14-29)21-13-28(2,3)36-16-23(21)26-32-33-27(34(25)26)37-17-24(35)30-15-19-7-5-4-6-8-19/h4-12,31H,13,15-17H2,1-3H3,(H,30,35)InChIKey
SROLZARIMOIBEF-UHFFFAOYSA-NSynonyms
900284-36-8900284368
CC1=CC=C(C=C1)NC2=C(C3=C(COC(C3)(C)C)C4=NN=C(N24)SCC(=O)NCC5=CC=CC=C5)C#N
InChI=1SC28H28N6O2Sc11891120(121018)312522(1429)211328(23)361623(21)26323327(34(25)26)371724(35)3015197546819h41231H131517H213H3(H3035)
MFCD06774173
Nbenzyl2((6cyano88dimethyl5((4methylphenyl)amino)710dihydro8Hpyrano(34c)(124)triazolo(43a)pyridin3yl)sulfanyl)acetamide
Nbenzyl2((6cyano88dimethyl5(ptolylamino)810dihydro7Hpyrano(34c)(124)triazolo(43a)pyridin3yl)thio)acetamide
ZINC000009450406
ZINC09450406
ZINC9450406
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