Vitas-M small molecule compound
1-cyclopentyl-4-(4-ethoxyphenyl)-7-hydroxy-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STK565671
SMILES CCOc1ccc(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 C19H23N3O3S MW 373.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O3S/c1-2-25-14-9-7-12(8-10-14)17-16-18(20-15(23)11-26-17)22(21-19(16)24)13-5-3-4-6-13/h7-10,13,17H,2-6,11H2,1H3,(H,20,23)(H,21,24)InChIKey
KKFLHPZDDSGZCH-UHFFFAOYSA-NSynonyms
578720-72-6(4R)1CYCLOPENTYL4(4ETHOXYPHENYL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
1CYCLOPENTYL4(4ETHOXYPHENYL)48DIHYDRO2HPYRAZOLO(34E)(14)THIAZEPINE37DIONE
1cyclopentyl4(4ethoxyphenyl)7hydroxy1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
578720726
CCOC1=CC=C(C=C1)C2C3=C(NC(=O)CS2)N(NC3=O)C4CCCC4
CCOc1ccc(cc1)C1SCC(=Nc2c1c(=O)(nH)n2C1CCCC1)O
InChI=1SC19H23N3O3Sc1225149712(81014)171618(2015(23)112617)22(2119(16)24)13534613h7101317H2611H21H3(H2023)(H2124)
MFCD04081199
ZINC000005644999
ZINC000005645013
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