Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-{[(1-phenylethyl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK261646
SMILES O=C1N(N=C(/C/1=C\NC(c1ccccc1)C)c1ccccc1)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 C25H20N4OS MW 424.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N4OS/c1-17(18-10-4-2-5-11-18)26-16-20-23(19-12-6-3-7-13-19)28-29(24(20)30)25-27-21-14-8-9-15-22(21)31-25/h2-17,26H,1H3/b20-16+InChIKey
HDLBYRNZZOZVLE-CAPFRKAQSA-NSynonyms
(4E)2(13BENZOTHIAZOL2YL)5PHENYL4(((1PHENYLETHYL)AMINO)METHYLIDENE)24DIHYDRO3HPYRAZOL3ONE
(4E)2(13BENZOTHIAZOL2YL)5PHENYL4((1PHENYLETHYLAMINO)METHYLIDENE)PYRAZOL3ONE
1BENZOTHIAZOL2YL3PHENYL4(((PHENYLETHYL)AMINO)METHYLENE)12DIAZOLIN5ONE
2(13BENZOTHIAZOL2YL)5PHENYL4(((1PHENYLETHYL)IMINO)METHYL)12DIHYDRO3HPYRAZOL3ONE
CC(C1=CC=CC=C1)NC=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5
InChI=1SC25H20N4OSc117(18104251118)26162023(19126371319)2829(24(20)30)25272114891522(21)3125h21726H1H3b2016+
MFCD01243985
O=C1N(N=C(C1=CNC(c1ccccc1)C)c1ccccc1)c1nc2c(s1)cccc2
ZINC000018244237
ZINC000018244239
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