Vitas-M small molecule compound

[1-(1,3-benzothiazol-2-yl)-5-phenyl-1H-pyrazol-3-yl](4-benzylpiperazin-1-yl)methanone

Catalog ID
STL441955
SMILES O=C(c1nn(c(c1)c1ccccc1)c1nc2c(s1)cccc2)N1CCN(CC1)Cc1ccccc1

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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 C28H25N5OS MW 479.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N5OS/c34-27(32-17-15-31(16-18-32)20-21-9-3-1-4-10-21)24-19-25(22-11-5-2-6-12-22)33(30-24)28-29-23-13-7-8-14-26(23)35-28/h1-14,19H,15-18,20H2
InChIKey
ALQUHPRTQDMKCN-UHFFFAOYSA-N
Synonyms

(1(13benzothiazol2yl)5phenyl1Hpyrazol3yl)(4benzylpiperazin1yl)methanone
(1(13benzothiazol2yl)5phenylpyrazol3yl)(4benzylpiperazin1yl)methanone
(1(BENZO(D)THIAZOL2YL)5PHENYL1HPYRAZOL3YL)(4BENZYLPIPERAZIN1YL)METHANONE
C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=NN(C(=C3)C4=CC=CC=C4)C5=NC6=CC=CC=C6S5
InChI=1SC28H25N5OSc3427(32171531(161832)202193141021)241925(22115261222)33(3024)28292313781426(23)3528h11419H151820H2
MFCD09992643
ZINC000033435900
ZINC33435900

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Available files

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