Vitas-M small molecule compound
N-[(5-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)methyl]-4-methoxybenzamide
Catalog ID
STK267210
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1c1ccccc1)SCC(=O)NC(C)(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 C23H27N5O3S MW 453.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O3S/c1-23(2,3)25-20(29)15-32-22-27-26-19(28(22)17-8-6-5-7-9-17)14-24-21(30)16-10-12-18(31-4)13-11-16/h5-13H,14-15H2,1-4H3,(H,24,30)(H,25,29)InChIKey
VYVXDQRFPSAPIW-UHFFFAOYSA-NSynonyms
CC(C)(C)NC(=O)CSC1=NN=C(N1C2=CC=CC=C2)CNC(=O)C3=CC=C(C=C3)OC
InChI=1SC23H27N5O3Sc123(23)2520(29)153222272619(28(22)178657917)142421(30)16101218(314)131116h513H1415H214H3(H2430)(H2529)
MFCD09267853
N((5((2(TERTBUTYLAMINO)2OXOETHYL)SULFANYL)4PHENYL4H124TRIAZOL3YL)METHYL)4METHOXYBENZAMIDE
N((5(2(tertbutylamino)2oxoethyl)sulfanyl4phenyl124triazol3yl)methyl)4methoxybenzamide
N(5(TERTBUTYLCARBAMOYLMETHYLSULFANYL)4PHENYL4H(124)TRIAZOL3YLMETHYL)4METHOXYBENZAMIDE
ZINC000009526180
ZINC09526180
ZINC9526180
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