Vitas-M small molecule compound
2-(3-{[5-(3,4-dimethoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}propyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STK807730
SMILES COc1cc(ccc1OC)c1nnc(n1C)SCCCn1c(=O)c2cccc3c2c(c1=O)ccc3
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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 C26H24N4O4S MW 488.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O4S/c1-29-23(17-11-12-20(33-2)21(15-17)34-3)27-28-26(29)35-14-6-13-30-24(31)18-9-4-7-16-8-5-10-19(22(16)18)25(30)32/h4-5,7-12,15H,6,13-14H2,1-3H3InChIKey
QFMDRZLOKJBNSF-UHFFFAOYSA-NSynonyms
690249-54-82(3((5(34DIMETHOXYPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)PROPYL)BENZO(DE)ISOQUINOLINE13DIONE
2(3((5(34dimethoxyphenyl)4methyl4H124triazol3yl)sulfanyl)propyl)1Hbenzo(de)isoquinoline13(2H)dione
2(3((5(34DIMETHOXYPHENYL)4METHYL4H124TRIAZOL3YL)THIO)PROPYL)1HBENZO(DE)ISOQUINOLINE13(2H)DIONE
690249548
CN1C(=NN=C1SCCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C5=CC(=C(C=C5)OC)OC
InChI=1SC26H24N4O4Sc12923(17111220(332)21(1517)343)272826(29)35146133024(31)1894716851019(22(16)18)25(30)32h4571215H61314H213H3
MFCD05865798
ZINC000009489465
ZINC09489465
ZINC9489465
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