Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK000737
SMILES COc1ccc(cc1)C1=NN(C(=O)/C/1=C/NCCN1CCOCC1)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 C24H25N5O3S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5O3S/c1-31-18-8-6-17(7-9-18)22-19(16-25-10-11-28-12-14-32-15-13-28)23(30)29(27-22)24-26-20-4-2-3-5-21(20)33-24/h2-9,16,25H,10-15H2,1H3/b19-16+InChIKey
IAJWDLURLKLQCX-KNTRCKAVSA-NSynonyms
(4E)2(13BENZOTHIAZOL2YL)5(4METHOXYPHENYL)4(((2(MORPHOLIN4YL)ETHYL)AMINO)METHYLIDENE)24DIHYDRO3HPYRAZOL3ONE
(4E)2(13BENZOTHIAZOL2YL)5(4METHOXYPHENYL)4((2MORPHOLIN4YLETHYLAMINO)METHYLIDENE)PYRAZOL3ONE
COC1=CC=C(C=C1)C2=NN(C(=O)C2=CNCCN3CCOCC3)C4=NC5=CC=CC=C5S4
COc1ccc(cc1)C1=NN(C(=O)C1=CNCCN1CCOCC1)c1nc2c(s1)cccc2
InChI=1SC24H25N5O3Sc131188617(7918)2219(1625101128121432151328)23(30)29(2722)242620423521(20)3324h291625H1015H21H3b1916+
MFCD03712457
STK000737
ZINC000100795460
ZINC100795460
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