Vitas-M small molecule compound

1,3-benzothiazol-2-yl[1-phenyl-4-(thiophen-2-ylcarbonyl)-1H-pyrazol-3-yl]methanone

Catalog ID
STK678993
SMILES O=C(c1nn(cc1C(=O)c1cccs1)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 C22H13N3O2S2 MW 415.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13N3O2S2/c26-20(18-11-6-12-28-18)15-13-25(14-7-2-1-3-8-14)24-19(15)21(27)22-23-16-9-4-5-10-17(16)29-22/h1-13H
InChIKey
ADQFIXLLJFQORN-UHFFFAOYSA-N
Synonyms

(3(13BENZOTHIAZOLE2CARBONYL)1PHENYLPYRAZOL4YL)THIOPHEN2YLMETHANONE
13benzothiazol2yl(1phenyl4(thiophen2ylcarbonyl)1Hpyrazol3yl)methanone
BENZOTHIAZOL2YL1PHENYL4(2THIENYLCARBONYL)PYRAZOL3YLKETONE
C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)C3=NC4=CC=CC=C4S3)C(=O)C5=CC=CS5
InChI=1SC22H13N3O2S2c2620(18116122818)151325(147213814)2419(15)21(27)2223169451017(16)2922h113H
MFCD02070029
ZINC000001071117
ZINC01071117
ZINC1071117

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Available files

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