Vitas-M small molecule compound

2-(3-{[4-(4-methoxyphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propyl)-1H-isoindole-1,3(2H)-dione

Catalog ID
STK807117
SMILES COc1ccc(cc1)n1c(SCCCN2C(=O)c3c(C2=O)cccc3)nnc1c1cccs1

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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 C24H20N4O3S2 MW 476.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O3S2/c1-31-17-11-9-16(10-12-17)28-21(20-8-4-14-32-20)25-26-24(28)33-15-5-13-27-22(29)18-6-2-3-7-19(18)23(27)30/h2-4,6-12,14H,5,13,15H2,1H3
InChIKey
BXLYRBRTPGKKFU-UHFFFAOYSA-N
Synonyms

2(3((4(4methoxyphenyl)5(thiophen2yl)4H124triazol3yl)sulfanyl)propyl)1Hisoindole13(2H)dione
2(3((4(4METHOXYPHENYL)5THIOPHEN2YL124TRIAZOL3YL)SULFANYL)PROPYL)ISOINDOLE13DIONE
2(3(4(4METHOXYPHENYL)5(2THIENYL)124TRIAZOL3YLTHIO)PROPYL)BENZO(C)AZOLINE13DIONE
COC1=CC=C(C=C1)N2C(=NN=C2SCCCN3C(=O)C4=CC=CC=C4C3=O)C5=CC=CS5
InChI=1SC24H20N4O3S2c1311711916(101217)2821(2084143220)252624(28)33155132722(29)18623719(18)23(27)30h2461214H51315H21H3
MFCD03621263
ZINC000002833182
ZINC02833182
ZINC2833182

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Available files

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