Vitas-M small molecule compound
2-(3-{[4-phenyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STK807740
SMILES O=c1n(CCCSc2nnc(n2c2ccccc2)c2cccnc2)c(=O)c2c3c1cccc3ccc2
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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 C28H21N5O2S MW 491.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N5O2S/c34-26-22-13-4-8-19-9-5-14-23(24(19)22)27(35)32(26)16-7-17-36-28-31-30-25(20-10-6-15-29-18-20)33(28)21-11-2-1-3-12-21/h1-6,8-15,18H,7,16-17H2InChIKey
ZNMVVRREABQCMI-UHFFFAOYSA-NSynonyms
690249-64-02(3((4phenyl5(pyridin3yl)4H124triazol3yl)sulfanyl)propyl)1Hbenzo(de)isoquinoline13(2H)dione
2(3((4PHENYL5(PYRIDIN3YL)4H124TRIAZOL3YL)THIO)PROPYL)1HBENZO(DE)ISOQUINOLINE13(2H)DIONE
2(3((4PHENYL5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)PROPYL)BENZO(DE)ISOQUINOLINE13DIONE
690249640
C1=CC=C(C=C1)N2C(=NN=C2SCCCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O)C6=CN=CC=C6
InChI=1SC28H21N5O2Sc342622134819951423(24(19)22)27(35)32(26)167173628313025(2010615291820)33(28)21112131221h1681518H71617H2
MFCD05865808
ZINC000009489605
ZINC09489605
ZINC9489605
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