Vitas-M small molecule compound
2-(3-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STK807787
SMILES Cn1c(SCCCn2c(=O)c3cccc4c3c(c2=O)ccc4)nnc1c1ccncc1
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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 C23H19N5O2S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5O2S/c1-27-20(16-9-11-24-12-10-16)25-26-23(27)31-14-4-13-28-21(29)17-7-2-5-15-6-3-8-18(19(15)17)22(28)30/h2-3,5-12H,4,13-14H2,1H3InChIKey
BWQAENFJEUVHFY-UHFFFAOYSA-NSynonyms
836665-63-52(3((4methyl5(pyridin4yl)4H124triazol3yl)sulfanyl)propyl)1Hbenzo(de)isoquinoline13(2H)dione
2(3((4METHYL5(PYRIDIN4YL)4H124TRIAZOL3YL)THIO)PROPYL)1HBENZO(DE)ISOQUINOLINE13(2H)DIONE
2(3((4METHYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)PROPYL)BENZO(DE)ISOQUINOLINE13DIONE
836665635
CN1C(=NN=C1SCCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C5=CC=NC=C5
InChI=1SC23H19N5O2Sc12720(1691124121016)252623(27)31144132821(29)177251563818(19(15)17)22(28)30h23512H41314H21H3
MFCD05885197
ZINC000012080491
ZINC12080491
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