Vitas-M small molecule compound
6-chloro-4-phenyl-3-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}quinolin-2(1H)-one
Catalog ID
STK089022
SMILES C=CCn1c(nnc1c1ccncc1)Sc1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)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/c1-2-14-31-23(17-10-12-27-13-11-17)29-30-25(31)33-22-21(16-6-4-3-5-7-16)19-15-18(26)8-9-20(19)28-24(22)32/h2-13,15H,1,14H2,(H,28,32)InChIKey
GABKWBJJFUGLAA-UHFFFAOYSA-NSynonyms
6CHLORO4PHENYL3((4(PROP2EN1YL)5(PYRIDIN4YL)4H124TRIAZOL3YL)SULFANYL)QUINOLIN2(1H)ONE
6CHLORO4PHENYL3((4PROP2ENYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)1HQUINOLIN2ONE
C=CCN1C(=NN=C1SC2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4)C5=CC=NC=C5
C=CCn1c(nnc1c1ccncc1)Sc1c(=O)(nH)c2c(c1c1ccccc1)cc(cc2)Cl
InChI=1SC25H18ClN5OSc12143123(17101227131117)293025(31)332221(166435716)191518(26)8920(19)2824(22)32h21315H114H2(H2832)
MFCD04056206
STK089022
ZINC000002784735
ZINC02784735
ZINC2784735
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