Vitas-M small molecule compound
2-(5-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-N-(3,4-dimethylphenyl)acetamide
Catalog ID
STK288990
SMILES O=C(Cc1nnc(n1C)SCC(=O)N1CCc2c(C1)cccc2)Nc1ccc(c(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 C24H27N5O2S MW 449.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O2S/c1-16-8-9-20(12-17(16)2)25-22(30)13-21-26-27-24(28(21)3)32-15-23(31)29-11-10-18-6-4-5-7-19(18)14-29/h4-9,12H,10-11,13-15H2,1-3H3,(H,25,30)InChIKey
XROWNDOPGBVWDX-UHFFFAOYSA-NSynonyms
2(5((2(34DIHYDROISOQUINOLIN2(1H)YL)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)N(34DIMETHYLPHENYL)ACETAMIDE
2(5(2(34dihydro1Hisoquinolin2yl)2oxoethyl)sulfanyl4methyl124triazol3yl)N(34dimethylphenyl)acetamide
2(5(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)N(34DIMETHYLPHENYL)ACETAMIDE
CC1=C(C=C(C=C1)NC(=O)CC2=NN=C(N2C)SCC(=O)N3CCC4=CC=CC=C4C3)C
InChI=1SC24H27N5O2Sc1168920(1217(16)2)2522(30)1321262724(28(21)3)321523(31)29111018645719(18)1429h4912H10111315H213H3(H2530)
MFCD09039580
ZINC000013567161
ZINC13567161
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