Vitas-M small molecule compound
4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-[(2Z)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide
Catalog ID
STK929462
SMILES COCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)c2nsc3c2cccc3)/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 C19H22N6O3S2 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N6O3S2/c1-28-12-16-21-22-19(29-16)20-15(26)6-7-17(27)24-8-10-25(11-9-24)18-13-4-2-3-5-14(13)30-23-18/h2-5H,6-12H2,1H3,(H,20,22,26)InChIKey
LQMUZLSAYQQNQY-UHFFFAOYSA-NSynonyms
1190279-95-81190279958
4(4(12benzothiazol3yl)piperazin1yl)N((2Z)5(methoxymethyl)134thiadiazol2(3H)ylidene)4oxobutanamide
COCC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)C3=NSC4=CC=CC=C43
COCc1n(nH)c(=NC(=O)CCC(=O)N2CCN(CC2)c2nsc3c2cccc3)s1
InChI=1SC19H22N6O3S2c1281216212219(2916)2015(26)6717(27)2481025(11924)1813423514(13)302318h25H612H21H3(H202226)
MFCD18176374
ZINC000036357314
ZINC36357314
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