Vitas-M small molecule compound

6-[(E)-2-(4-methylphenyl)ethenyl]-3-(pyrazin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK854969
SMILES Cc1ccc(cc1)/C=C/c1nn2c(s1)nnc2c1cnccn1

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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 C16H12N6S MW 320.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N6S/c1-11-2-4-12(5-3-11)6-7-14-21-22-15(19-20-16(22)23-14)13-10-17-8-9-18-13/h2-10H,1H3/b7-6+
InChIKey
JJFWKAMBAJEKIF-VOTSOKGWSA-N
Synonyms
878441-84-0
(E)6(4methylstyryl)3(pyrazin2yl)(124)triazolo(34b)(134)thiadiazole
3PYRAZIN2YL6((E)2PTOLYLVINYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
6((E)2(4methylphenyl)ethenyl)3(pyrazin2yl)(124)triazolo(34b)(134)thiadiazole
6((E)2(4METHYLPHENYL)ETHENYL)3PYRAZIN2YL(124)TRIAZOLO(34B)(134)THIADIAZOLE
878441840
CC1=CC=C(C=C1)C=CC2=NN3C(=NN=C3S2)C4=NC=CN=C4
Cc1ccc(cc1)C=Cc1nn2c(s1)nnc2c1cnccn1
InChI=1SC16H12N6Sc1112412(5311)6714212215(192016(22)2314)131017891813h210H1H3b76+
MFCD07400820
ZINC000004776390
ZINC04776390
ZINC4776390

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Available files

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