Vitas-M small molecule compound
3-(4-chlorophenyl)-4-(thiophen-3-yl)-2,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Catalog ID
STK847949
SMILES O=C1Nc2n[nH]c(c2C(C1)c1cscc1)c1ccc(cc1)Cl
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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 C16H12ClN3OS MW 329.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN3OS/c17-11-3-1-9(2-4-11)15-14-12(10-5-6-22-8-10)7-13(21)18-16(14)20-19-15/h1-6,8,12H,7H2,(H2,18,19,20,21)InChIKey
LLAPIMWUSGGRIL-UHFFFAOYSA-NSynonyms
878431-00-63(4chlorophenyl)4(thiophen3yl)2457tetrahydro6Hpyrazolo(34b)pyridin6one
3(4chlorophenyl)4(thiophen3yl)45dihydro1Hpyrazolo(34b)pyridin6(7H)one
3(4chlorophenyl)4thiophen3yl1245tetrahydropyrazolo(34b)pyridin6one
878431006
C1C(C2=C(NNC2=NC1=O)C3=CC=C(C=C3)Cl)C4=CSC=C4
InChI=1SC16H12ClN3OSc1711319(2411)151412(105622810)713(21)1816(14)201915h16812H7H2(H218192021)
MFCD07202102
O=C1CC(c2cscc2)c2c(N1)(nH)nc2c1ccc(cc1)Cl
O=C1Nc2n(nH)c(c2C(C1)c1cscc1)c1ccc(cc1)Cl
ZINC000009110659
ZINC000009110660
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