Vitas-M small molecule compound
4-[3-methoxy-2-(propan-2-yloxy)phenyl]-2,6-dihydro-4H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK641716
SMILES COc1cccc(c1OC(C)C)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 C16H19N3O3S MW 333.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O3S/c1-9(2)22-14-10(5-4-6-12(14)21-3)15-11-7-17-19-16(11)18-13(20)8-23-15/h4-7,9,15H,8H2,1-3H3,(H2,17,18,19,20)InChIKey
NWVPGUMISCHRRK-UHFFFAOYSA-NSynonyms
1172487-98-71172487987
4(3methoxy2(propan2yloxy)phenyl)26dihydro4Hpyrazolo(34e)(14)thiazepin7ol
4(3methoxy2propan2yloxyphenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
CC(C)OC1=C(C=CC=C1OC)C2C3=CNNC3=NC(=O)CS2
COc1cccc(c1OC(C)C)C1SCC(=Nc2c1c(nH)n2)O
InChI=1SC16H19N3O3Sc19(2)221410(54612(14)213)15117171916(11)1813(20)82315h47915H8H213H3(H217181920)
MFCD18162730
ZINC000020733699
ZINC000020733702
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