Vitas-M small molecule compound

(4Z)-4-[2-(2,4-dimethylphenyl)hydrazinylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide

Catalog ID
STK088449
SMILES Cc1ccc(c(c1)C)N/N=C\1/C(=NN(C1=O)C(=S)N)c1ccccc1

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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 C18H17N5OS MW 351.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5OS/c1-11-8-9-14(12(2)10-11)20-21-16-15(13-6-4-3-5-7-13)22-23(17(16)24)18(19)25/h3-10,20H,1-2H3,(H2,19,25)/b21-16-
InChIKey
BNLUOVIBWMCHAG-PGMHBOJBSA-N
Synonyms

(4Z)4((24DIMETHYLPHENYL)HYDRAZINYLIDENE)5OXO3PHENYLPYRAZOLE1CARBOTHIOAMIDE
(4Z)4(2(24DIMETHYLPHENYL)HYDRAZINYLIDENE)5OXO3PHENYL45DIHYDRO1HPYRAZOLE1CARBOTHIOAMIDE
CC1=CC(=C(C=C1)NN=C2C(=NN(C2=O)C(=S)N)C3=CC=CC=C3)C
Cc1ccc(c(c1)C)NN=C1C(=NN(C1=O)C(=S)N)c1ccccc1
InChI=1SC18H17N5OSc1118914(12(2)1011)20211615(136435713)2223(17(16)24)18(19)25h31020H12H3(H21925)b2116
MFCD01418592
STK088449
ZINC000005489086
ZINC100530526

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Available files

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