Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-4-(1-{[2-(1H-imidazol-4-yl)ethyl]amino}ethylidene)-5-(4-methoxyphenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK207394
SMILES COc1ccc(cc1)C1=NN(C(=O)/C/1=C(\NCCc1c[nH]cn1)/C)c1nc2c(s1)cccc2
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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 C24H22N6O2S MW 458.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N6O2S/c1-15(26-12-11-17-13-25-14-27-17)21-22(16-7-9-18(32-2)10-8-16)29-30(23(21)31)24-28-19-5-3-4-6-20(19)33-24/h3-10,13-14,26H,11-12H2,1-2H3,(H,25,27)/b21-15-InChIKey
CSECJSXJELEQQS-QNGOZBTKSA-NSynonyms
(4Z)2(13benzothiazol2yl)4(1((2(1Himidazol4yl)ethyl)amino)ethylidene)5(4methoxyphenyl)24dihydro3Hpyrazol3one
(4Z)2(13benzothiazol2yl)4(1(2(1Himidazol5yl)ethylamino)ethylidene)5(4methoxyphenyl)pyrazol3one
(Z)4(1((2(1Himidazol4yl)ethyl)amino)ethylidene)1(benzo(d)thiazol2yl)3(4methoxyphenyl)1Hpyrazol5(4H)one
1BENZOTHIAZOL2YL4(((2IMIDAZOL4YLETHYL)AMINO)ETHYLIDENE)3(4METHOXYPHENYL)12DIAZOLIN5ONE
CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=C(C=C4)OC)NCCC5=CN=CN5
COc1ccc(cc1)C1=NN(C(=O)C1=C(NCCc1c(nH)cn1)C)c1nc2c(s1)cccc2
InChI=1SC24H22N6O2Sc115(261211171325142717)2122(167918(322)10816)2930(23(21)31)242819534620(19)3324h310131426H1112H212H3(H2527)b2115
MFCD06754556
ZINC000095483241
ZINC09059733
ZINC95483241
Check stock
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Check stock on Vitas-MAvailable files
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