Vitas-M small molecule compound

3-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-5-[(4-nitrobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole

Catalog ID
STK806933
SMILES C=CCn1c(nnc1c1sc2c(c1Cl)ccc(c2)OC)SCc1ccc(cc1)[N+](=O)[O-]

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C21H17ClN4O3S2 MW 472.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN4O3S2/c1-3-10-25-20(19-18(22)16-9-8-15(29-2)11-17(16)31-19)23-24-21(25)30-12-13-4-6-14(7-5-13)26(27)28/h3-9,11H,1,10,12H2,2H3
InChIKey
MQZCJMRPWRITKA-UHFFFAOYSA-N
Synonyms
489402-92-8
3(3chloro6methoxy1benzothiophen2yl)5((4nitrobenzyl)sulfanyl)4(prop2en1yl)4H124triazole
3(3CHLORO6METHOXY1BENZOTHIOPHEN2YL)5((4NITROPHENYL)METHYLSULFANYL)4PROP2ENYL124TRIAZOLE
3CHLORO6METHOXY2(5((4NITROPHENYL)METHYLTHIO)4PROP2ENYL(124TRIAZOL3YL))BENZO(B)THIOPHENE
489402928
4ALLYL3(3CHLORO6METHOXYBENZO(B)THIOPHEN2YL)5((4NITROBENZYL)THIO)4H124TRIAZOLE
C=CCn1c(nnc1c1sc2c(c1Cl)ccc(c2)OC)SCc1ccc(cc1)(N+)(=O)(O)
COC1=CC2=C(C=C1)C(=C(S2)C3=NN=C(N3CC=C)SCC4=CC=C(C=C4)(N+)(=O)(O))Cl
InChI=1SC21H17ClN4O3S2c13102520(1918(22)169815(292)1117(16)3119)232421(25)3012134614(7513)26(27)28h3911H11012H22H3
MFCD03296002
ZINC000001830487
ZINC01830487
ZINC1830487

Check stock

See real-time availability and sample size for STK806933 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.