Vitas-M small molecule compound
1-cyclopentyl-7-hydroxy-4-(2,3,4-trifluorophenyl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL316221
SMILES OC1=Nc2c(C(SC1)c1ccc(c(c1F)F)F)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 C17H16F3N3O2S MW 383.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16F3N3O2S/c18-10-6-5-9(13(19)14(10)20)15-12-16(21-11(24)7-26-15)23(22-17(12)25)8-3-1-2-4-8/h5-6,8,15H,1-4,7H2,(H,21,24)(H,22,25)InChIKey
VGIVHJCAOCFFTJ-UHFFFAOYSA-NSynonyms
1435977-91-51435977915
1cyclopentyl4(234trifluorophenyl)48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
1cyclopentyl7hydroxy4(234trifluorophenyl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
C1CCC(C1)N2C3=C(C(SCC(=O)N3)C4=C(C(=C(C=C4)F)F)F)C(=O)N2
InChI=1SC17H16F3N3O2Sc1810659(13(19)14(10)20)151216(2111(24)72615)23(2217(12)25)831248h56815H147H2(H2124)(H2225)
MFCD28027696
OC1=Nc2c(C(SC1)c1ccc(c(c1F)F)F)c(=O)(nH)n2C1CCCC1
ZINC000095477615
ZINC000095477616
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