Vitas-M small molecule compound
6-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-5-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Catalog ID
STK978328
SMILES Clc1cc2OCOc2cc1CSc1nc2[nH]ncc2c(=O)n1c1ccccc1
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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 C19H13ClN4O3S MW 412.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClN4O3S/c20-14-7-16-15(26-10-27-16)6-11(14)9-28-19-22-17-13(8-21-23-17)18(25)24(19)12-4-2-1-3-5-12/h1-8H,9-10H2,(H,21,23)InChIKey
WZGTZAODHSPSIQ-UHFFFAOYSA-NSynonyms
869075-16-16(((6chloro13benzodioxol5yl)methyl)sulfanyl)5phenyl15dihydro4Hpyrazolo(34d)pyrimidin4one
6((6CHLORO(2HBENZO(D)13DIOXOLEN5YL))METHYLTHIO)5PHENYL5HYDROPYRAZOLO(54D)PYRIMIDIN4ONE
6((6CHLORO13BENZODIOXOL5YL)METHYLSULFANYL)5PHENYL1HPYRAZOLO(34D)PYRIMIDIN4ONE
869075161
C1OC2=C(O1)C=C(C(=C2)CSC3=NC4=C(C=NN4)C(=O)N3C5=CC=CC=C5)Cl
Clc1cc2OCOc2cc1CSc1nc2(nH)ncc2c(=O)n1c1ccccc1
InChI=1SC19H13ClN4O3Sc201471615(26102716)611(14)92819221713(8212317)18(25)24(19)124213512h18H910H2(H2123)
MFCD05885371
ZINC000004248577
ZINC04248577
ZINC4248577
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