Vitas-M small molecule compound
N-[(2Z)-4-methyl-1,3-thiazol-2(3H)-ylidene]-1-(3-phenyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carboxamide
Catalog ID
STL157809
SMILES O=C(C1CCN(CC1)c1ccc2n(n1)c(nn2)c1ccccc1)/N=c/1\scc([nH]1)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 C21H21N7OS MW 419.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N7OS/c1-14-13-30-21(22-14)23-20(29)16-9-11-27(12-10-16)18-8-7-17-24-25-19(28(17)26-18)15-5-3-2-4-6-15/h2-8,13,16H,9-12H2,1H3,(H,22,23,29)InChIKey
NGKHCPLUSICPFO-UHFFFAOYSA-NSynonyms
1049136-38-01049136380
CC1=CSC(=N1)NC(=O)C2CCN(CC2)C3=NN4C(=NN=C4C5=CC=CC=C5)C=C3
InChI=1SC21H21N7OSc114133021(2214)2320(29)1691127(121016)188717242519(28(17)2618)155324615h281316H912H21H3(H222329)
MFCD20758135
N((2Z)4methyl13thiazol2(3H)ylidene)1(3phenyl(124)triazolo(43b)pyridazin6yl)piperidine4carboxamide
O=C(C1CCN(CC1)c1ccc2n(n1)c(nn2)c1ccccc1)N=c1scc((nH)1)C
ZINC000044584811
ZINC44584811
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