Vitas-M small molecule compound
4-[3-(prop-2-yn-1-yloxy)phenyl]-2,6-dihydro-4H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK642604
SMILES C#CCOc1cccc(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 C15H13N3O2S MW 299.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O2S/c1-2-6-20-11-5-3-4-10(7-11)14-12-8-16-18-15(12)17-13(19)9-21-14/h1,3-5,7-8,14H,6,9H2,(H2,16,17,18,19)InChIKey
VHVMBLBQJGZBQG-UHFFFAOYSA-NSynonyms
1170197-66-61170197666
4(3(prop2yn1yloxy)phenyl)26dihydro4Hpyrazolo(34e)(14)thiazepin7ol
4(3prop2ynoxyphenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
C#CCOC1=CC=CC(=C1)C2C3=CNNC3=NC(=O)CS2
C#CCOc1cccc(c1)C1SCC(=Nc2c1c(nH)n2)O
InChI=1SC15H13N3O2Sc126201153410(711)14128161815(12)1713(19)92114h1357814H69H2(H216171819)
MFCD18163029
ZINC000020722552
ZINC000020722555
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