Vitas-M small molecule compound
4-(4-bromophenyl)-2,6-dihydro-4H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK633421
SMILES Brc1ccc(cc1)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 C12H10BrN3OS MW 324.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10BrN3OS/c13-8-3-1-7(2-4-8)11-9-5-14-16-12(9)15-10(17)6-18-11/h1-5,11H,6H2,(H2,14,15,16,17)InChIKey
HUIOHVMHWALDNK-UHFFFAOYSA-NSynonyms
1170618-57-11170618571
4(4bromophenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
4(4bromophenyl)26dihydro4Hpyrazolo(34e)(14)thiazepin7ol
Brc1ccc(cc1)C1SCC(=Nc2c1c(nH)n2)O
C1C(=O)N=C2C(=CNN2)C(S1)C3=CC=C(C=C3)Br
InChI=1SC12H10BrN3OSc138317(248)1195141612(9)1510(17)61811h1511H6H2(H214151617)
MFCD18160093
ZINC000020732059
ZINC000020732063
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