Vitas-M small molecule compound
3-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)propanamide
Catalog ID
STL421512
SMILES NC(=O)CC(c1c(C)nn(c1C)C1CCS(=O)(=O)C1)c1c(C)[nH]nc1O
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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 C16H23N5O4S MW 381.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23N5O4S/c1-8-15(16(23)19-18-8)12(6-13(17)22)14-9(2)20-21(10(14)3)11-4-5-26(24,25)7-11/h11-12H,4-7H2,1-3H3,(H2,17,22)(H2,18,19,23)InChIKey
VWBJKTMONVVFTH-UHFFFAOYSA-NSynonyms
1630866-37-31630866373
3(1(11dioxidotetrahydrothiophen3yl)35dimethyl1Hpyrazol4yl)3(3hydroxy5methyl1Hpyrazol4yl)propanamide
3(1(11dioxothiolan3yl)35dimethylpyrazol4yl)3(3methyl5oxo12dihydropyrazol4yl)propanamide
CC1=C(C(=O)NN1)C(CC(=O)N)C2=C(N(N=C2C)C3CCS(=O)(=O)C3)C
InChI=1SC16H23N5O4Sc1815(16(23)19188)12(613(17)22)149(2)2021(10(14)3)114526(2425)711h1112H47H213H3(H21722)(H2181923)
MFCD30707574
NC(=O)CC(c1c(C)nn(c1C)C1CCS(=O)(=O)C1)c1c(C)(nH)nc1O
ZINC000218151283
ZINC000218151514
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