Vitas-M small molecule compound
methyl [(4Z)-1-(1,3-benzothiazol-2-yl)-4-{1-[(2-hydroxyethyl)amino]ethylidene}-5-oxo-4,5-dihydro-1H-pyrazol-3-yl]acetate
Catalog ID
STK234749
SMILES OCCN/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)CC(=O)OC)/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 C17H18N4O4S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O4S/c1-10(18-7-8-22)15-12(9-14(23)25-2)20-21(16(15)24)17-19-11-5-3-4-6-13(11)26-17/h3-6,18,22H,7-9H2,1-2H3/b15-10-InChIKey
HYCRSKQXRXROTN-GDNBJRDFSA-NSynonyms
(Z)methyl2(1(benzo(d)thiazol2yl)4(1((2hydroxyethyl)amino)ethylidene)5oxo45dihydro1Hpyrazol3yl)acetate
CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)CC(=O)OC)NCCO
InChI=1SC17H18N4O4Sc110(187822)1512(914(23)252)2021(16(15)24)171911534613(11)2617h361822H79H212H3b1510
methyl((4Z)1(13benzothiazol2yl)4(1((2hydroxyethyl)amino)ethylidene)5oxo45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)1(13BENZOTHIAZOL2YL)4(1(2HYDROXYETHYLAMINO)ETHYLIDENE)5OXOPYRAZOL3YL)ACETATE
METHYL2(1BENZOTHIAZOL2YL4(((2HYDROXYETHYL)AMINO)ETHYLIDENE)5OXO12DIAZOLIN3YL)ACETATE
MFCD07792733
OCCNC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)CC(=O)OC)C
ZINC000004999629
ZINC04999629
ZINC4999629
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