Vitas-M small molecule compound
ethyl 2-{[(pyridin-2-ylmethyl)carbamothioyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK456184
SMILES CCOC(=O)c1c(NC(=S)NCc2ccccn2)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 C19H23N3O2S2 MW 389.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O2S2/c1-2-24-18(23)16-14-9-4-3-5-10-15(14)26-17(16)22-19(25)21-12-13-8-6-7-11-20-13/h6-8,11H,2-5,9-10,12H2,1H3,(H2,21,22,25)InChIKey
PEIBSRPDQNDNSW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=S)NCC3=CC=CC=N3
ethyl2(((pyridin2ylmethyl)carbamothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2(pyridin2ylmethylcarbamothioylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC19H23N3O2S2c122418(23)161494351015(14)2617(16)2219(25)211213867112013h6811H2591012H21H3(H2212225)
MFCD04292928
ZINC000002854933
ZINC02854933
ZINC2854933
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Check stock on Vitas-MAvailable files
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