Vitas-M small molecule compound

(4Z)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-[4-(diethylamino)benzylidene]-5-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK050944
SMILES CCN(c1ccc(cc1)/C=C\1/C(=NN(C1=O)c1scc(n1)c1ccc(cc1)Cl)c1ccccc1)CC

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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 C29H25ClN4OS MW 513.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25ClN4OS/c1-3-33(4-2)24-16-10-20(11-17-24)18-25-27(22-8-6-5-7-9-22)32-34(28(25)35)29-31-26(19-36-29)21-12-14-23(30)15-13-21/h5-19H,3-4H2,1-2H3/b25-18-
InChIKey
KBOKRZMEQKTDCZ-BWAHOGKJSA-N
Synonyms

(4Z)2(4(4CHLOROPHENYL)13THIAZOL2YL)4((4(DIETHYLAMINO)PHENYL)METHYLIDENE)5PHENYLPYRAZOL3ONE
(4Z)2(4(4CHLOROPHENYL)13THIAZOL2YL)4(4(DIETHYLAMINO)BENZYLIDENE)5PHENYL24DIHYDRO3HPYRAZOL3ONE
2(4(4CHLOROPHENYL)13THIAZOL2YL)4(4(DIETHYLAMINO)BENZYLIDENE)5PHENYL24DIHYDRO3HPYRAZOL3ONE
CCN(c1ccc(cc1)C=C1C(=NN(C1=O)c1scc(n1)c1ccc(cc1)Cl)c1ccccc1)CC
CCN(CC)C1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=NC(=CS3)C4=CC=C(C=C4)Cl)C5=CC=CC=C5
InChI=1SC29H25ClN4OSc1333(42)24161020(111724)182527(228657922)3234(28(25)35)293126(193629)21121423(30)151321h519H34H212H3b2518
MFCD01445534
STK050944
ZINC000006143138
ZINC06143138
ZINC6143138

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Available files

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