Vitas-M small molecule compound
4-[4-(dimethylamino)phenyl]-7-hydroxy-1-(pentan-2-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STK559723
SMILES CCCC(n1[nH]c(=O)c2c1N=C(O)CSC2c1ccc(cc1)N(C)C)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 C19H26N4O2S MW 374.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N4O2S/c1-5-6-12(2)23-18-16(19(25)21-23)17(26-11-15(24)20-18)13-7-9-14(10-8-13)22(3)4/h7-10,12,17H,5-6,11H2,1-4H3,(H,20,24)(H,21,25)InChIKey
VHBHELFMIBWADH-UHFFFAOYSA-NSynonyms
573697-99-1(4R)4(4(DIMETHYLAMINO)PHENYL)1((2S)PENTAN2YL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
(4S)4(4(DIMETHYLAMINO)PHENYL)1((2R)PENTAN2YL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
4(4(DIMETHYLAMINO)PHENYL)1(1METHYLBUTYL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
4(4(dimethylamino)phenyl)1pentan2yl48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
4(4(dimethylamino)phenyl)7hydroxy1(pentan2yl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
4(4DIMETHYLAMINOPHENYL)1PENTAN2YL48DIHYDRO2HPYRAZOLO(34E)(14)THIAZEPINE37DIONE
573697991
CCCC(C)N1C2=C(C(SCC(=O)N2)C3=CC=C(C=C3)N(C)C)C(=O)N1
CCCC(n1(nH)c(=O)c2c1N=C(O)CSC2c1ccc(cc1)N(C)C)C
InChI=1SC19H26N4O2Sc15612(2)231816(19(25)2123)17(261115(24)2018)137914(10813)22(3)4h7101217H5611H214H3(H2024)(H2125)
MFCD04078439
ZINC000005643056
ZINC000005643170
Check stock
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Check stock on Vitas-MAvailable files
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