Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-4-(1-{[2-(1H-imidazol-4-yl)ethyl]amino}propylidene)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK207392
SMILES CC/C(=C/1\C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1)/NCCc1c[nH]cn1
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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 C24H22N6OS MW 442.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N6OS/c1-2-18(26-13-12-17-14-25-15-27-17)21-22(16-8-4-3-5-9-16)29-30(23(21)31)24-28-19-10-6-7-11-20(19)32-24/h3-11,14-15,26H,2,12-13H2,1H3,(H,25,27)/b21-18-InChIKey
VUXVRWYWLUCPJO-UZYVYHOESA-NSynonyms
(4Z)2(13benzothiazol2yl)4(1((2(1Himidazol4yl)ethyl)amino)propylidene)5phenyl24dihydro3Hpyrazol3one
(4Z)2(13benzothiazol2yl)4(1(2(1Himidazol5yl)ethylamino)propylidene)5phenylpyrazol3one
1BENZOTHIAZOL2YL4(((2IMIDAZOL4YLETHYL)AMINO)PROPYLIDENE)3PHENYL12DIAZOLIN5ONE
CCC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1)NCCc1c(nH)cn1
CCC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4)NCCC5=CN=CN5
InChI=1SC24H22N6OSc1218(261312171425152717)2122(168435916)2930(23(21)31)24281910671120(19)3224h311141526H21213H21H3(H2527)b2118
MFCD06754540
ZINC000100432862
ZINC09972291
ZINC100432862
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