Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-4-butyl-5-methyl-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK620766
SMILES CCCCc1c(C)[nH]n(c1=O)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 C15H17N3OS MW 287.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N3OS/c1-3-4-7-11-10(2)17-18(14(11)19)15-16-12-8-5-6-9-13(12)20-15/h5-6,8-9,17H,3-4,7H2,1-2H3InChIKey
WPBBXYVQSWQQGQ-UHFFFAOYSA-NSynonyms
106690-13-51(2BENZOTHIAZOLYL)4BUTYL3METHYL5PYRAZOLOL
106690135
1BENZOTHIAZOL2YL4BUTYL3METHYLPYRAZOL5OL
2(13benzothiazol2yl)4butyl5methyl12dihydro3Hpyrazol3one
2(13BENZOTHIAZOL2YL)4BUTYL5METHYL1HPYRAZOL3ONE
4BUTYL1(2BENZOTHIAZOLYL)3METHYLPYRAZOL5OL
CCCCC1=C(NN(C1=O)C2=NC3=CC=CC=C3S2)C
CCCCc1c(C)(nH)n(c1=O)c1nc2c(s1)cccc2
InChI=1SC15H17N3OSc13471110(2)1718(14(11)19)151612856913(12)2015h568917H347H212H3
MFCD09790688
PYRAZOL5OL1(2BENZOTHIAZOLYL)4BUTYL3METHYL
ZINC000013552385
ZINC100068853
ZINC13552385
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