Vitas-M small molecule compound
4-[4-(benzyloxy)phenyl]-3-hydroxy-1-(propan-2-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Catalog ID
STK553453
SMILES O=C1CSC(c2c(N1)n(nc2O)C(C)C)c1ccc(cc1)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 C22H23N3O3S MW 409.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3S/c1-14(2)25-21-19(22(27)24-25)20(29-13-18(26)23-21)16-8-10-17(11-9-16)28-12-15-6-4-3-5-7-15/h3-11,14,20H,12-13H2,1-2H3,(H,23,26)(H,24,27)InChIKey
GOTODONRGYJFQE-UHFFFAOYSA-NSynonyms
692264-67-8(4R)4(4(BENZYLOXY)PHENYL)1(PROPAN2YL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
4(4(benzyloxy)phenyl)3hydroxy1(propan2yl)48dihydro1Hpyrazolo(34e)(14)thiazepin7(6H)one
4(4(benzyloxy)phenyl)3hydroxy1isopropyl68dihydro1Hpyrazolo(34e)(14)thiazepin7(4H)one
4(4PHENYLMETHOXYPHENYL)1PROPAN2YL48DIHYDRO2HPYRAZOLO(34E)(14)THIAZEPINE37DIONE
692264678
CC(C)N1C2=C(C(SCC(=O)N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)N1
InChI=1SC22H23N3O3Sc114(2)252119(22(27)2425)20(291318(26)2321)1681017(11916)2812156435715h3111420H1213H212H3(H2326)(H2427)
MFCD03627917
ZINC000005823001
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