Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-4-(1-{[3-(morpholin-4-yl)propyl]amino}ethylidene)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK049217
SMILES C/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1)/NCCCN1CCOCC1
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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 C25H27N5O2S MW 461.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O2S/c1-18(26-12-7-13-29-14-16-32-17-15-29)22-23(19-8-3-2-4-9-19)28-30(24(22)31)25-27-20-10-5-6-11-21(20)33-25/h2-6,8-11,26H,7,12-17H2,1H3/b22-18+InChIKey
ZVIJYAGMGDVWHU-RELWKKBWSA-NSynonyms
(4E)2(13BENZOTHIAZOL2YL)4(1((3(MORPHOLIN4YL)PROPYL)AMINO)ETHYLIDENE)5PHENYL24DIHYDRO3HPYRAZOL3ONE
(4E)2(13BENZOTHIAZOL2YL)4(1(3MORPHOLIN4YLPROPYLAMINO)ETHYLIDENE)5PHENYLPYRAZOL3ONE
(E)1(benzo(d)thiazol2yl)4(1((3morpholinopropyl)amino)ethylidene)3phenyl1Hpyrazol5(4H)one
2(13BENZOTHIAZOL2YL)4((1E)N(3(MORPHOLIN4YL)PROPYL)ETHANIMIDOYL)5PHENYL12DIHYDRO3HPYRAZOL3ONE
4((1E)1METHYL5MORPHOLIN4YL2AZAPENT1ENYL)1BENZOTHIAZOL2YL3PHENYL3PYRAZOLIN5ONE
CC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1)NCCCN1CCOCC1
CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4)NCCCN5CCOCC5
InChI=1SC25H27N5O2Sc118(261271329141632171529)2223(198324919)2830(24(22)31)25272010561121(20)3325h2681126H71217H21H3b2218+
MFCD01945898
STK049217
ZINC000100095562
ZINC100095562
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