Vitas-M small molecule compound
4-[3-(benzyloxy)phenyl]-2,6-dihydro-4H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK632565
SMILES OC1=Nc2n[nH]cc2C(SC1)c1cccc(c1)OCc1ccccc1
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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 C19H17N3O2S MW 351.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O2S/c23-17-12-25-18(16-10-20-22-19(16)21-17)14-7-4-8-15(9-14)24-11-13-5-2-1-3-6-13/h1-10,18H,11-12H2,(H2,20,21,22,23)InChIKey
WQCZZVKBFLWTGG-UHFFFAOYSA-NSynonyms
1170919-68-21170919682
4(3(benzyloxy)phenyl)26dihydro4Hpyrazolo(34e)(14)thiazepin7ol
4(3phenylmethoxyphenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
C1C(=O)N=C2C(=CNN2)C(S1)C3=CC(=CC=C3)OCC4=CC=CC=C4
InChI=1SC19H17N3O2Sc2317122518(1610202219(16)2117)1474815(914)2411135213613h11018H1112H2(H220212223)
MFCD18159817
OC1=Nc2n(nH)cc2C(SC1)c1cccc(c1)OCc1ccccc1
ZINC000020745960
ZINC000020745961
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