Vitas-M small molecule compound

4-(3-hydroxyphenyl)-2,6-dihydro-4H-pyrazolo[3,4-e][1,4]thiazepin-7-ol

Catalog ID
STK641272
SMILES Oc1cccc(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 C12H11N3O2S MW 261.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N3O2S/c16-8-3-1-2-7(4-8)11-9-5-13-15-12(9)14-10(17)6-18-11/h1-5,11,16H,6H2,(H2,13,14,15,17)
InChIKey
RWBZNACFWHGERD-UHFFFAOYSA-N
Synonyms
1170490-14-8
1170490148
4(3hydroxyphenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
4(3hydroxyphenyl)26dihydro4Hpyrazolo(34e)(14)thiazepin7ol
C1C(=O)N=C2C(=CNN2)C(S1)C3=CC(=CC=C3)O
InChI=1SC12H11N3O2Sc1683127(48)1195131512(9)1410(17)61811h151116H6H2(H213141517)
MFCD18162601
Oc1cccc(c1)C1SCC(=Nc2c1c(nH)n2)O
ZINC000020716109
ZINC000020716113

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Available files

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