Vitas-M small molecule compound
1-(butan-2-yl)-4-(2-methoxyphenyl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7(2H,6H)-dione
Catalog ID
STL494742
SMILES CCC(n1[nH]c(=O)c2c1NC(=O)CSC2c1ccccc1OC)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 C17H21N3O3S MW 347.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O3S/c1-4-10(2)20-16-14(17(22)19-20)15(24-9-13(21)18-16)11-7-5-6-8-12(11)23-3/h5-8,10,15H,4,9H2,1-3H3,(H,18,21)(H,19,22)InChIKey
SFDRUSLZKZRGIW-UHFFFAOYSA-NSynonyms
714917-53-0(4R)1((2S)BUTAN2YL)4(2METHOXYPHENYL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
(4S)1((2S)BUTAN2YL)4(2METHOXYPHENYL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
1(BUTAN2YL)4(2METHOXYPHENYL)46DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37DIOL
1(butan2yl)4(2methoxyphenyl)48dihydro1Hpyrazolo(34e)(14)thiazepine37(2H6H)dione
1BUTAN2YL4(2METHOXYPHENYL)48DIHYDRO2HPYRAZOLO(34E)(14)THIAZEPINE37DIONE
714917530
CCC(C)N1C2=C(C(SCC(=O)N2)C3=CC=CC=C3OC)C(=O)N1
CCC(n1(nH)c(=O)c2c1NC(=O)CSC2c1ccccc1OC)C
InChI=1SC17H21N3O3Sc1410(2)201614(17(22)1920)15(24913(21)1816)11756812(11)233h581015H49H213H3(H1821)(H1922)
MFCD30716601
ZINC000009357313
ZINC000009357323
Check stock
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Check stock on Vitas-MAvailable files
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