Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-4-[(cyclohexylamino)methylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL357430
SMILES CC1=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 C18H20N4OS MW 340.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4OS/c1-12-14(11-19-13-7-3-2-4-8-13)17(23)22(21-12)18-20-15-9-5-6-10-16(15)24-18/h5-6,9-11,13,19H,2-4,7-8H2,1H3/b14-11-InChIKey
BEJSAHSRNBFOJL-KAMYIIQDSA-NSynonyms
(4Z)2(13benzothiazol2yl)4((cyclohexylamino)methylidene)5methyl24dihydro3Hpyrazol3one
(4Z)2(13benzothiazol2yl)4((cyclohexylamino)methylidene)5methylpyrazol3one
(E)1(benzo(d)thiazol2yl)4((cyclohexylamino)methylene)3methyl1Hpyrazol5(4H)one
CC1=NN(C(=O)C1=CNC1CCCCC1)c1nc2c(s1)cccc2
CC1=NN(C(=O)C1=CNC2CCCCC2)C3=NC4=CC=CC=C4S3
InChI=1SC18H20N4OSc11214(1119137324813)17(23)22(2112)1820159561016(15)2418h569111319H2478H21H3b1411
MFCD02300147
ZINC000017994397
ZINC17994397
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