Vitas-M small molecule compound

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

Catalog ID
STK018839
SMILES Clc1ccc(cc1)SCC1=NN(C(=O)/C/1=C(\N1CCOCC1)/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 C23H21ClN4O2S2 MW 485.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN4O2S2/c1-15(27-10-12-30-13-11-27)21-19(14-31-17-8-6-16(24)7-9-17)26-28(22(21)29)23-25-18-4-2-3-5-20(18)32-23/h2-9H,10-14H2,1H3/b21-15-
InChIKey
WYTQZTPTKWRJJU-QNGOZBTKSA-N
Synonyms
1053054-72-0
(4Z)2(13BENZOTHIAZOL2YL)5(((4CHLOROPHENYL)SULFANYL)METHYL)4(1(MORPHOLIN4YL)ETHYLIDENE)24DIHYDRO3HPYRAZOL3ONE
(4Z)2(13BENZOTHIAZOL2YL)5((4CHLOROPHENYL)SULFANYLMETHYL)4(1MORPHOLIN4YLETHYLIDENE)PYRAZOL3ONE
(Z)1(benzo(d)thiazol2yl)3(((4chlorophenyl)thio)methyl)4(1morpholinoethylidene)1Hpyrazol5(4H)one
1053054720
CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)CSC4=CC=C(C=C4)Cl)N5CCOCC5
Clc1ccc(cc1)SCC1=NN(C(=O)C1=C(N1CCOCC1)C)c1nc2c(s1)cccc2
InChI=1SC23H21ClN4O2S2c115(27101230131127)2119(1431178616(24)7917)2628(22(21)29)232518423520(18)3223h29H1014H21H3b2115
MFCD01811113
STK018839
ZINC000000671898
ZINC00671898
ZINC671898

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Available files

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