Vitas-M small molecule compound
1-cyclopentyl-7-hydroxy-4-(3-hydroxyphenyl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL316118
SMILES Oc1cccc(c1)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 C17H19N3O3S MW 345.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O3S/c21-12-7-3-4-10(8-12)15-14-16(18-13(22)9-24-15)20(19-17(14)23)11-5-1-2-6-11/h3-4,7-8,11,15,21H,1-2,5-6,9H2,(H,18,22)(H,19,23)InChIKey
WUUKJBKCHMTPHI-UHFFFAOYSA-NSynonyms
1436000-23-51436000235
1cyclopentyl4(3hydroxyphenyl)48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
1cyclopentyl7hydroxy4(3hydroxyphenyl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
C1CCC(C1)N2C3=C(C(SCC(=O)N3)C4=CC(=CC=C4)O)C(=O)N2
InChI=1SC17H19N3O3Sc211273410(812)151416(1813(22)92415)20(1917(14)23)11512611h3478111521H12569H2(H1822)(H1923)
MFCD28027635
Oc1cccc(c1)C1SCC(=Nc2c1c(=O)(nH)n2C1CCCC1)O
ZINC000095477537
ZINC000095477538
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