Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-4-{1-[(2-hydroxyethyl)amino]ethylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK013749
SMILES OCCN/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)C)/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 C15H16N4O2S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O2S/c1-9(16-7-8-20)13-10(2)18-19(14(13)21)15-17-11-5-3-4-6-12(11)22-15/h3-6,16,20H,7-8H2,1-2H3/b13-9-InChIKey
XFKKTGWSKMDNHF-LCYFTJDESA-NSynonyms
299443-56-4(4Z)2(13BENZOTHIAZOL2YL)4(1((2HYDROXYETHYL)AMINO)ETHYLIDENE)5METHYL24DIHYDRO3HPYRAZOL3ONE
(4Z)2(13BENZOTHIAZOL2YL)4(1(2HYDROXYETHYLAMINO)ETHYLIDENE)5METHYLPYRAZOL3ONE
299443564
CC1=NN(C(=O)C1=C(C)NCCO)C2=NC3=CC=CC=C3S2
InChI=1SC15H16N4O2Sc19(167820)1310(2)1819(14(13)21)151711534612(11)2215h361620H78H212H3b139
MFCD02208451
OCCNC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)C)C
STK013749
ZINC000100095609
ZINC100095609
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