Vitas-M small molecule compound
4-{3-[(3-chlorobenzyl)oxy]phenyl}-2,6-dihydro-4H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK638876
SMILES Clc1cccc(c1)COc1cccc(c1)C1SCC(=Nc2c1c[nH]n2)O
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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/c20-14-5-1-3-12(7-14)10-25-15-6-2-4-13(8-15)18-16-9-21-23-19(16)22-17(24)11-26-18/h1-9,18H,10-11H2,(H2,21,22,23,24)InChIKey
VTISMIFAZXNZDK-UHFFFAOYSA-NSynonyms
1171662-53-51171662535
4(3((3chlorobenzyl)oxy)phenyl)26dihydro4Hpyrazolo(34e)(14)thiazepin7ol
4(3((3chlorophenyl)methoxy)phenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
C1C(=O)N=C2C(=CNN2)C(S1)C3=CC(=CC=C3)OCC4=CC(=CC=C4)Cl
Clc1cccc(c1)COc1cccc(c1)C1SCC(=Nc2c1c(nH)n2)O
InChI=1SC19H16ClN3O2Sc201451312(714)10251562413(815)18169212319(16)2217(24)112618h1918H1011H2(H221222324)
MFCD18161815
ZINC000020721436
ZINC000020721439
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