Vitas-M small molecule compound
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-phenyl-6-(thiophen-2-yl)[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
Catalog ID
STL175035
SMILES N#Cc1c(sc2c1CCCCC2)NC(=O)c1cc(nc2c1c(no2)c1ccccc1)c1cccs1
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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 C27H20N4O2S2 MW 496.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N4O2S2/c28-15-19-17-10-5-2-6-11-21(17)35-27(19)30-25(32)18-14-20(22-12-7-13-34-22)29-26-23(18)24(31-33-26)16-8-3-1-4-9-16/h1,3-4,7-9,12-14H,2,5-6,10-11H2,(H,30,32)InChIKey
KILHZYUHNICVFV-UHFFFAOYSA-NSynonyms
C1CCC2=C(CC1)SC(=C2C#N)NC(=O)C3=CC(=NC4=C3C(=NO4)C5=CC=CC=C5)C6=CC=CS6
InChI=1SC27H20N4O2S2c28151917105261121(17)3527(19)3025(32)181420(22127133422)292623(18)24(313326)168314916h134791214H2561011H2(H3032)
MFCD08557712
N(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)3phenyl6(thiophen2yl)(12)oxazolo(54b)pyridine4carboxamide
N(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)3phenyl6thiophen2yl(12)oxazolo(54b)pyridine4carboxamide
ZINC000013641494
ZINC13641494
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