Vitas-M small molecule compound
N-[1-(5-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK221591
SMILES CCn1c(SCC(=O)N2CCc3c(C2)cccc3)nnc1C(NC(=O)c1ccccc1)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/c1-3-29-22(17(2)25-23(31)19-10-5-4-6-11-19)26-27-24(29)32-16-21(30)28-14-13-18-9-7-8-12-20(18)15-28/h4-12,17H,3,13-16H2,1-2H3,(H,25,31)InChIKey
IUAKYJHRBCDNBC-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)N2CCC3=CC=CC=C3C2)C(C)NC(=O)C4=CC=CC=C4
InChI=1SC24H27N5O2Sc132922(17(2)2523(31)19105461119)262724(29)321621(30)281413189781220(18)1528h41217H31316H212H3(H2531)
MFCD07398897
N(1(5((2(34DIHYDROISOQUINOLIN2(1H)YL)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
N(1(5(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)BENZAMIDE
ZINC000009263262
ZINC000009263264
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