Vitas-M small molecule compound
5-nitro-1-(propan-2-yl)-4-(thiophen-2-yl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-3,6(2H,5H)-dione
Catalog ID
STL434424
SMILES O=C1Nc2c(C(C1[N+](=O)[O-])c1cccs1)c(=O)[nH]n2C(C)C
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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 C13H14N4O4S MW 322.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4O4S/c1-6(2)16-11-9(12(18)15-16)8(7-4-3-5-22-7)10(17(20)21)13(19)14-11/h3-6,8,10H,1-2H3,(H,14,19)(H,15,18)InChIKey
GJDWWZRWWXBBOT-UHFFFAOYSA-NSynonyms
5nitro1(propan2yl)4(thiophen2yl)47dihydro1Hpyrazolo(34b)pyridine36(2H5H)dione
5nitro1propan2yl4thiophen2yl2457tetrahydropyrazolo(34b)pyridine36dione
CC(C)N1C2=C(C(C(C(=O)N2)(N+)(=O)(O))C3=CC=CS3)C(=O)N1
InChI=1SC13H14N4O4Sc16(2)16119(12(18)1516)8(7435227)10(17(20)21)13(19)1411h36810H12H3(H1419)(H1518)
MFCD26098831
O=C1Nc2c(C(C1(N+)(=O)(O))c1cccs1)c(=O)(nH)n2C(C)C
ZINC000100255110
ZINC000100255119
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