Vitas-M small molecule compound
N-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-methyl-1H-pyrazol-5-yl]-2-(6-hydroxy-2-methyl-4-oxoquinazolin-3(4H)-yl)acetamide
Catalog ID
STL247493
SMILES O=C(Nc1cc(nn1C1CCS(=O)(=O)C1)C)Cn1c(C)nc2c(c1=O)cc(cc2)O
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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 C19H21N5O5S MW 431.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O5S/c1-11-7-17(24(22-11)13-5-6-30(28,29)10-13)21-18(26)9-23-12(2)20-16-4-3-14(25)8-15(16)19(23)27/h3-4,7-8,13,25H,5-6,9-10H2,1-2H3,(H,21,26)InChIKey
ZZCCJUFHQSTFJG-UHFFFAOYSA-NSynonyms
1374534-31-21374534312
CC1=NN(C(=C1)NC(=O)CN2C(=NC3=C(C2=O)C=C(C=C3)O)C)C4CCS(=O)(=O)C4
InChI=1SC19H21N5O5Sc111717(24(2211)135630(2829)1013)2118(26)92312(2)20164314(25)815(16)19(23)27h34781325H56910H212H3(H2126)
MFCD22202441
N(1(11dioxidotetrahydrothiophen3yl)3methyl1Hpyrazol5yl)2(6hydroxy2methyl4oxoquinazolin3(4H)yl)acetamide
N(2(11dioxothiolan3yl)5methylpyrazol3yl)2(6hydroxy2methyl4oxoquinazolin3yl)acetamide
ZINC000072403745
ZINC000072403746
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