Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-[1-(propylamino)ethylidene]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK143070
SMILES CCCN/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1)/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 C21H20N4OS MW 376.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4OS/c1-3-13-22-14(2)18-19(15-9-5-4-6-10-15)24-25(20(18)26)21-23-16-11-7-8-12-17(16)27-21/h4-12,22H,3,13H2,1-2H3/b18-14-InChIKey
SUXDDDFTKQAJDT-JXAWBTAJSA-NSynonyms
(4Z)2(13BENZOTHIAZOL2YL)5PHENYL4(1(PROPYLAMINO)ETHYLIDENE)24DIHYDRO3HPYRAZOL3ONE
(4Z)2(13BENZOTHIAZOL2YL)5PHENYL4(1(PROPYLAMINO)ETHYLIDENE)PYRAZOL3ONE
(Z)1(benzo(d)thiazol2yl)3phenyl4(1(propylamino)ethylidene)1Hpyrazol5(4H)one
CCCNC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1)C
CCCNC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4)C
InChI=1SC21H20N4OSc13132214(2)1819(1595461015)2425(20(18)26)21231611781217(16)2721h41222H313H212H3b1814
MFCD02617232
ZINC000100398867
ZINC09356326
ZINC100398867
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