Vitas-M small molecule compound
4-{4-[2-(naphthalen-1-yloxy)ethyl]piperazin-1-yl}-4-oxo-N-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Catalog ID
STK569292
SMILES CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)CCOc2cccc3c2cccc3)/s1
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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 C25H31N5O3S MW 481.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O3S/c1-2-6-23-27-28-25(34-23)26-22(31)11-12-24(32)30-15-13-29(14-16-30)17-18-33-21-10-5-8-19-7-3-4-9-20(19)21/h3-5,7-10H,2,6,11-18H2,1H3,(H,26,28,31)InChIKey
XWAWSFRNVYVYSJ-UHFFFAOYSA-NSynonyms
716332-04-64(4(2(naphthalen1yloxy)ethyl)piperazin1yl)4oxoN((2Z)5propyl134thiadiazol2(3H)ylidene)butanamide
4(4(2NAPHTHALEN1YLOXYETHYL)PIPERAZIN1YL)4OXON(5PROPYL134THIADIAZOL2YL)BUTANAMIDE
716332046
CCCC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)CCOC3=CC=CC4=CC=CC=C43
CCCc1n(nH)c(=NC(=O)CCC(=O)N2CCN(CC2)CCOc2cccc3c2cccc3)s1
InChI=1SC25H31N5O3Sc12623272825(3423)2622(31)111224(32)30151329(141630)17183321105819734920(19)21h35710H261118H21H3(H262831)
MFCD05738048
ZINC000016956389
ZINC16956389
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