Vitas-M small molecule compound
N-[(5-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-3-methylbenzamide
Catalog ID
STK230337
SMILES Cc1cccc(c1)C(=O)NCc1nnc(n1C)SCC(=O)N1CCc2c(C1)cccc2
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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 C23H25N5O2S MW 435.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O2S/c1-16-6-5-9-18(12-16)22(30)24-13-20-25-26-23(27(20)2)31-15-21(29)28-11-10-17-7-3-4-8-19(17)14-28/h3-9,12H,10-11,13-15H2,1-2H3,(H,24,30)InChIKey
SXDPMNXDLLQIRJ-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1)C(=O)NCC2=NN=C(N2C)SCC(=O)N3CCC4=CC=CC=C4C3
InChI=1SC23H25N5O2Sc11665918(1216)22(30)241320252623(27(20)2)311521(29)28111017734819(17)1428h3912H10111315H212H3(H2430)
MFCD07790351
N((5((2(34DIHYDROISOQUINOLIN2(1H)YL)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)3METHYLBENZAMIDE
N((5(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)3METHYLBENZAMIDE
ZINC000009263279
ZINC09263279
ZINC9263279
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