Vitas-M small molecule compound
4-[4-(pyridin-2-ylmethoxy)phenyl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STL314308
SMILES OC1=Nc2[nH]ncc2C(SC1)c1ccc(cc1)OCc1ccccn1
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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 C18H16N4O2S MW 352.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O2S/c23-16-11-25-17(15-9-20-22-18(15)21-16)12-4-6-14(7-5-12)24-10-13-3-1-2-8-19-13/h1-9,17H,10-11H2,(H2,20,21,22,23)InChIKey
LQTCJQIRMVINBJ-UHFFFAOYSA-NSynonyms
1401592-98-01401592980
4(4(pyridin2ylmethoxy)phenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
4(4(pyridin2ylmethoxy)phenyl)46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
C1C(=O)N=C2C(=CNN2)C(S1)C3=CC=C(C=C3)OCC4=CC=CC=N4
InChI=1SC18H16N4O2Sc2316112517(159202218(15)2116)124614(7512)24101331281913h1917H1011H2(H220212223)
MFCD28030620
OC1=Nc2(nH)ncc2C(SC1)c1ccc(cc1)OCc1ccccn1
ZINC000079480878
ZINC000079480883
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