Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-4-{1-[(3-methoxypropyl)amino]ethylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK231921
SMILES COCCCN/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)C)/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 C17H20N4O2S MW 344.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O2S/c1-11(18-9-6-10-23-3)15-12(2)20-21(16(15)22)17-19-13-7-4-5-8-14(13)24-17/h4-5,7-8,18H,6,9-10H2,1-3H3/b15-11-InChIKey
XPWFREXTSYQIKH-PTNGSMBKSA-NSynonyms
(4Z)2(13benzothiazol2yl)4(1((3methoxypropyl)amino)ethylidene)5methyl24dihydro3Hpyrazol3one
(4Z)2(13BENZOTHIAZOL2YL)4(1(3METHOXYPROPYLAMINO)ETHYLIDENE)5METHYLPYRAZOL3ONE
1BENZOTHIAZOL2YL4(((3METHOXYPROPYL)AMINO)ETHYLIDENE)3METHYL12DIAZOLIN5ONE
CC1=NN(C(=O)C1=C(C)NCCCOC)C2=NC3=CC=CC=C3S2
COCCCNC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)C)C
InChI=1SC17H20N4O2Sc111(189610233)1512(2)2021(16(15)22)171913745814(13)2417h457818H6910H213H3b1511
MFCD07792704
ZINC000100423016
ZINC100423016
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