Vitas-M small molecule compound
(4Z)-4-(1-aminopropylidene)-2-(1,3-benzothiazol-2-yl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK741884
SMILES CC/C(=C/1\C(=NN(C1=O)c1nc2c(s1)cccc2)C)/N
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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 C14H14N4OS MW 286.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N4OS/c1-3-9(15)12-8(2)17-18(13(12)19)14-16-10-6-4-5-7-11(10)20-14/h4-7H,3,15H2,1-2H3/b12-9-InChIKey
JIQISAJOIMVXMP-XFXZXTDPSA-NSynonyms
(4Z)4(1aminopropylidene)2(13benzothiazol2yl)5methyl24dihydro3Hpyrazol3one
(4Z)4(1AMINOPROPYLIDENE)2(13BENZOTHIAZOL2YL)5METHYLPYRAZOL3ONE
CCC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)C)N
CCC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C)N
InChI=1SC14H14N4OSc139(15)128(2)1718(13(12)19)141610645711(10)2014h47H315H212H3b129
MFCD06014462
ZINC000017835569
ZINC17835569
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