Vitas-M small molecule compound
1-cyclooctyl-4-(thiophen-3-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7(2H,6H)-dione
Catalog ID
STL494221
SMILES O=C1CSC(c2c(N1)n([nH]c2=O)C1CCCCCCC1)c1cscc1
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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 C18H23N3O2S2 MW 377.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O2S2/c22-14-11-25-16(12-8-9-24-10-12)15-17(19-14)21(20-18(15)23)13-6-4-2-1-3-5-7-13/h8-10,13,16H,1-7,11H2,(H,19,22)(H,20,23)InChIKey
BIRXJYTWOKVHNE-UHFFFAOYSA-NSynonyms
1401585-78-11401585781
1CYCLOOCTYL4(THIOPHEN3YL)46DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37DIOL
1cyclooctyl4(thiophen3yl)48dihydro1Hpyrazolo(34e)(14)thiazepine37(2H6H)dione
1cyclooctyl4thiophen3yl48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
C1CCCC(CCC1)N2C3=C(C(SCC(=O)N3)C4=CSC=C4)C(=O)N2
InChI=1SC18H23N3O2S2c2214112516(1289241012)1517(1914)21(2018(15)23)13642135713h8101316H1711H2(H1922)(H2023)
MFCD30716267
O=C1CSC(c2c(N1)n((nH)c2=O)C1CCCCCCC1)c1cscc1
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