Vitas-M small molecule compound
4-{3-[(2-chlorobenzyl)oxy]phenyl}-2,6-dihydro-4H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK639325
SMILES OC1=Nc2n[nH]cc2C(SC1)c1cccc(c1)OCc1ccccc1Cl
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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 C19H16ClN3O2S MW 385.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O2S/c20-16-7-2-1-4-13(16)10-25-14-6-3-5-12(8-14)18-15-9-21-23-19(15)22-17(24)11-26-18/h1-9,18H,10-11H2,(H2,21,22,23,24)InChIKey
YYJWXSRRKWWMND-UHFFFAOYSA-NSynonyms
1170969-72-81170969728
4(3((2chlorobenzyl)oxy)phenyl)26dihydro4Hpyrazolo(34e)(14)thiazepin7ol
4(3((2chlorophenyl)methoxy)phenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
C1C(=O)N=C2C(=CNN2)C(S1)C3=CC(=CC=C3)OCC4=CC=CC=C4Cl
InChI=1SC19H16ClN3O2Sc2016721413(16)10251463512(814)18159212319(15)2217(24)112618h1918H1011H2(H221222324)
MFCD18161958
OC1=Nc2n(nH)cc2C(SC1)c1cccc(c1)OCc1ccccc1Cl
ZINC000020722535
ZINC000020722538
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