Vitas-M small molecule compound

(4Z)-2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-{1-[(3-fluorophenyl)amino]ethylidene}-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK073023
SMILES Clc1ccc(cc1)SCC1=NN(C(=O)/C/1=C(\Nc1cccc(c1)F)/C)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 C25H18ClFN4OS2 MW 509.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClFN4OS2/c1-15(28-18-6-4-5-17(27)13-18)23-21(14-33-19-11-9-16(26)10-12-19)30-31(24(23)32)25-29-20-7-2-3-8-22(20)34-25/h2-13,28H,14H2,1H3/b23-15-
InChIKey
SVUKEERJRXPADT-HAHDFKILSA-N
Synonyms

(4Z)2(13BENZOTHIAZOL2YL)5(((4CHLOROPHENYL)SULFANYL)METHYL)4(1((3FLUOROPHENYL)AMINO)ETHYLIDENE)24DIHYDRO3HPYRAZOL3ONE
(4Z)2(13BENZOTHIAZOL2YL)5((4CHLOROPHENYL)SULFANYLMETHYL)4(1(3FLUOROANILINO)ETHYLIDENE)PYRAZOL3ONE
(Z)1(benzo(d)thiazol2yl)3(((4chlorophenyl)thio)methyl)4(1((3fluorophenyl)amino)ethylidene)1Hpyrazol5(4H)one
1(13BENZOTHIAZOL2YL)3(((4CHLOROPHENYL)SULFANYL)METHYL)4((1E)N(3FLUOROPHENYL)ETHANIMIDOYL)1HPYRAZOL5OL
1BENZOTHIAZOL2YL3((4CHLOROPHENYLTHIO)METHYL)4(((3FLUOROPHENYL)AMINO)ETHYLIDENE)12DIAZOLIN5ONE
CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)CSC4=CC=C(C=C4)Cl)NC5=CC(=CC=C5)F
Clc1ccc(cc1)SCC1=NN(C(=O)C1=C(Nc1cccc(c1)F)C)c1nc2c(s1)cccc2
InChI=1SC25H18ClFN4OS2c115(281864517(27)1318)2321(14331911916(26)101219)3031(24(23)32)252920723822(20)3425h21328H14H21H3b2315
MFCD02375595
STK073023
ZINC000100748159
ZINC09065133
ZINC100748159

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Available files

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