Vitas-M small molecule compound
1-cyclopentyl-7-hydroxy-4-(4-methylphenyl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STK846334
SMILES Cc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C1CCCC1)O
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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 C18H21N3O2S MW 343.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O2S/c1-11-6-8-12(9-7-11)16-15-17(19-14(22)10-24-16)21(20-18(15)23)13-4-2-3-5-13/h6-9,13,16H,2-5,10H2,1H3,(H,19,22)(H,20,23)InChIKey
FDITWSSWIQMEGD-UHFFFAOYSA-NSynonyms
673452-71-61CYCLOPENTYL4(4METHYLPHENYL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
1CYCLOPENTYL4(4METHYLPHENYL)48DIHYDRO2HPYRAZOLO(34E)(14)THIAZEPINE37DIONE
1cyclopentyl7hydroxy4(4methylphenyl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
673452716
CC1=CC=C(C=C1)C2C3=C(NC(=O)CS2)N(NC3=O)C4CCCC4
Cc1ccc(cc1)C1SCC(=Nc2c1c(=O)(nH)n2C1CCCC1)O
InChI=1SC18H21N3O2Sc1116812(9711)161517(1914(22)102416)21(2018(15)23)13423513h691316H2510H21H3(H1922)(H2023)
MFCD04078957
ZINC000018038393
ZINC000018159281
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