Vitas-M small molecule compound
3-methyl-4-[3-(pyridin-2-ylmethoxy)phenyl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STL250788
SMILES OC1=Nc2[nH]nc(c2C(SC1)c1cccc(c1)OCc1ccccn1)C
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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 C19H18N4O2S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O2S/c1-12-17-18(26-11-16(24)21-19(17)23-22-12)13-5-4-7-15(9-13)25-10-14-6-2-3-8-20-14/h2-9,18H,10-11H2,1H3,(H2,21,22,23,24)InChIKey
FRRLECVYFPMVCU-UHFFFAOYSA-NSynonyms
1401534-13-11401534131
3methyl4(3(pyridin2ylmethoxy)phenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
3methyl4(3(pyridin2ylmethoxy)phenyl)46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
CC1=C2C(SCC(=O)N=C2NN1)C3=CC(=CC=C3)OCC4=CC=CC=N4
InChI=1SC19H18N4O2Sc1121718(261116(24)2119(17)232212)1354715(913)25101462382014h2918H1011H21H3(H221222324)
MFCD24852466
OC1=Nc2(nH)nc(c2C(SC1)c1cccc(c1)OCc1ccccn1)C
ZINC000079489387
ZINC000079489396
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