Vitas-M small molecule compound
methyl 2-{[4-(4-nitro-1H-pyrazol-1-yl)butanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK775615
SMILES COC(=O)c1c(NC(=O)CCCn2ncc(c2)[N+](=O)[O-])sc2c1CCCCC2
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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 C18H22N4O5S MW 406.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O5S/c1-27-18(24)16-13-6-3-2-4-7-14(13)28-17(16)20-15(23)8-5-9-21-11-12(10-19-21)22(25)26/h10-11H,2-9H2,1H3,(H,20,23)InChIKey
AQAQLMVHWVAOLW-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CCCN3C=C(C=N3)(N+)(=O)(O)
COC(=O)c1c(NC(=O)CCCn2ncc(c2)(N+)(=O)(O))sc2c1CCCCC2
InChI=1SC18H22N4O5Sc12718(24)16136324714(13)2817(16)2015(23)859211112(101921)22(25)26h1011H29H21H3(H2023)
methyl2((4(4nitro1Hpyrazol1yl)butanoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2(4(4nitropyrazol1yl)butanoylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD05257591
ZINC000004623263
ZINC04623263
ZINC4623263
Check stock
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