Vitas-M small molecule compound
3-[3-(4-chloro-3-methyl-1H-pyrazol-1-yl)propyl]-2-{[(3-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}quinazolin-4(3H)-one
Catalog ID
STK314371
SMILES [O-][N+](=O)c1ccn(n1)CSc1nc2ccccc2c(=O)n1CCCn1cc(c(n1)C)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 C19H18ClN7O3S MW 459.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN7O3S/c1-13-15(20)11-24(22-13)8-4-9-26-18(28)14-5-2-3-6-16(14)21-19(26)31-12-25-10-7-17(23-25)27(29)30/h2-3,5-7,10-11H,4,8-9,12H2,1H3InChIKey
IJVHSWNMMANOCC-UHFFFAOYSA-NSynonyms
1005643-43-5(O)(N+)(=O)c1ccn(n1)CSc1nc2ccccc2c(=O)n1CCCn1cc(c(n1)C)Cl
1005643435
3(3(4chloro3methyl1Hpyrazol1yl)propyl)2(((3nitro1Hpyrazol1yl)methyl)sulfanyl)quinazolin4(3H)one
3(3(4chloro3methylpyrazol1yl)propyl)2((3nitropyrazol1yl)methylsulfanyl)quinazolin4one
CC1=NN(C=C1Cl)CCCN2C(=O)C3=CC=CC=C3N=C2SCN4C=CC(=N4)(N+)(=O)(O)
InChI=1SC19H18ClN7O3Sc11315(20)1124(2213)8492618(28)14523616(14)2119(26)31122510717(2325)27(29)30h23571011H48912H21H3
MFCD05667784
ZINC000002733866
ZINC02733866
ZINC2733866
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