Vitas-M small molecule compound
1-cyclopentyl-7-hydroxy-4-(thiophen-3-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL311046
SMILES OC1=Nc2c(C(SC1)c1cscc1)c(=O)[nH]n2C1CCCC1
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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 C15H17N3O2S2 MW 335.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N3O2S2/c19-11-8-22-13(9-5-6-21-7-9)12-14(16-11)18(17-15(12)20)10-3-1-2-4-10/h5-7,10,13H,1-4,8H2,(H,16,19)(H,17,20)InChIKey
SAAOWBAADIRKOJ-UHFFFAOYSA-NSynonyms
1435908-13-61435908136
1cyclopentyl4thiophen3yl48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
1cyclopentyl7hydroxy4(thiophen3yl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
C1CCC(C1)N2C3=C(C(SCC(=O)N3)C4=CSC=C4)C(=O)N2
InChI=1SC15H17N3O2S2c191182213(9562179)1214(1611)18(1715(12)20)10312410h571013H148H2(H1619)(H1720)
MFCD28025877
OC1=Nc2c(C(SC1)c1cscc1)c(=O)(nH)n2C1CCCC1
ZINC000095473782
ZINC000095473783
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