Vitas-M small molecule compound

(2Z)-2-[(1-cyclopentyl-3-methyl-1H-pyrazol-4-yl)methylidene]-5-methyl-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one

Catalog ID
STL181708
SMILES Cc1nn(cc1/C=c/1\sc2=NC3(CC(n2c1=O)c1ccccc1O3)C)C1CCCC1

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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 C23H24N4O2S MW 420.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O2S/c1-14-15(13-26(25-14)16-7-3-4-8-16)11-20-21(28)27-18-12-23(2,24-22(27)30-20)29-19-10-6-5-9-17(18)19/h5-6,9-11,13,16,18H,3-4,7-8,12H2,1-2H3/b20-11-
InChIKey
AIRUMFCUUBVLNT-JAIQZWGSSA-N
Synonyms
1263038-63-6
(2Z)2((1cyclopentyl3methyl1Hpyrazol4yl)methylidene)5methyl5H11H511methano(13)thiazolo(23d)(135)benzoxadiazocin1(2H)one
1263038636
CC1=NN(C=C1C=C2C(=O)N3C4CC(N=C3S2)(OC5=CC=CC=C45)C)C6CCCC6
Cc1nn(cc1C=c1sc2=NC3(CC(n2c1=O)c1ccccc1O3)C)C1CCCC1
InChI=1SC23H24N4O2Sc11415(1326(2514)16734816)112021(28)27181223(22422(27)3020)29191065917(18)19h56911131618H347812H212H3b2011
MFCD20760082
ZINC000071785034

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Available files

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