Vitas-M small molecule compound
7-chloro-4-phenyl-3-{[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}quinolin-2(1H)-one
Catalog ID
STL043507
SMILES C=CCn1c(nnc1c1cccnc1)Sc1c(=O)[nH]c2c(c1c1ccccc1)ccc(c2)Cl
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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 C25H18ClN5OS MW 471.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClN5OS/c1-2-13-31-23(17-9-6-12-27-15-17)29-30-25(31)33-22-21(16-7-4-3-5-8-16)19-11-10-18(26)14-20(19)28-24(22)32/h2-12,14-15H,1,13H2,(H,28,32)InChIKey
DUDGSXCLIMVFDQ-UHFFFAOYSA-NSynonyms
354538-64-03((4ALLYL5(3PYRIDINYL)4H124TRIAZOL3YL)SULFANYL)7CHLORO4PHENYL2QUINOLINOL
354538640
7chloro4phenyl3((4(prop2en1yl)5(pyridin3yl)4H124triazol3yl)sulfanyl)quinolin2(1H)one
7CHLORO4PHENYL3((4PROP2ENYL5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)1HQUINOLIN2ONE
C=CCN1C(=NN=C1SC2=C(C3=C(C=C(C=C3)Cl)NC2=O)C4=CC=CC=C4)C5=CN=CC=C5
C=CCn1c(nnc1c1cccnc1)Sc1c(=O)(nH)c2c(c1c1ccccc1)ccc(c2)Cl
InChI=1SC25H18ClN5OSc12133123(179612271517)293025(31)332221(167435816)19111018(26)1420(19)2824(22)32h2121415H113H2(H2832)
MFCD03801074
ZINC000013773895
ZINC13773895
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