Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-4-[(cyclohexylamino)methylidene]-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK741759
SMILES CCCC1=NN(C(=O)/C/1=C/NC1CCCCC1)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 C20H24N4OS MW 368.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4OS/c1-2-8-16-15(13-21-14-9-4-3-5-10-14)19(25)24(23-16)20-22-17-11-6-7-12-18(17)26-20/h6-7,11-14,21H,2-5,8-10H2,1H3/b15-13+InChIKey
QCIQKKGGUIEFDE-FYWRMAATSA-NSynonyms
(4E)2(13benzothiazol2yl)4((cyclohexylamino)methylidene)5propyl24dihydro3Hpyrazol3one
(4E)2(13BENZOTHIAZOL2YL)4((CYCLOHEXYLAMINO)METHYLIDENE)5PROPYLPYRAZOL3ONE
(E)1(benzo(d)thiazol2yl)4((cyclohexylamino)methylene)3propyl1Hpyrazol5(4H)one
CCCC1=NN(C(=O)C1=CNC1CCCCC1)c1nc2c(s1)cccc2
CCCC1=NN(C(=O)C1=CNC2CCCCC2)C3=NC4=CC=CC=C4S3
InChI=1SC20H24N4OSc1281615(13211494351014)19(25)24(2316)20221711671218(17)2620h67111421H25810H21H3b1513+
MFCD01811070
ZINC000100163400
ZINC100163400
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