Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-4-[(heptylamino)methylidene]-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK741688
SMILES CCCCCCCN/C=C/1\C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1
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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 C24H26N4OS MW 418.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4OS/c1-2-3-4-5-11-16-25-17-19-22(18-12-7-6-8-13-18)27-28(23(19)29)24-26-20-14-9-10-15-21(20)30-24/h6-10,12-15,17,25H,2-5,11,16H2,1H3/b19-17+InChIKey
TTZMPHUYFZNRFO-HTXNQAPBSA-NSynonyms
(4E)2(13benzothiazol2yl)4((heptylamino)methylidene)5phenyl24dihydro3Hpyrazol3one
(4E)2(13benzothiazol2yl)4((heptylamino)methylidene)5phenylpyrazol3one
(E)1(benzo(d)thiazol2yl)4((heptylamino)methylene)3phenyl1Hpyrazol5(4H)one
CCCCCCCNC=C1C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1
CCCCCCCNC=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4
InChI=1SC24H26N4OSc12345111625171922(18127681318)2728(23(19)29)242620149101521(20)3024h61012151725H251116H21H3b1917+
MFCD01210571
ZINC000008384516
ZINC8384516
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