Vitas-M small molecule compound
ethyl 2-({[(1-ethyl-1H-pyrazol-4-yl)carbonyl]carbamothioyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK317666
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2cnn(c2)CC)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 C19H24N4O3S2 MW 420.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N4O3S2/c1-3-23-11-12(10-20-23)16(24)21-19(27)22-17-15(18(25)26-4-2)13-8-6-5-7-9-14(13)28-17/h10-11H,3-9H2,1-2H3,(H2,21,22,24,27)InChIKey
IRLGKAVSTKRBHP-UHFFFAOYSA-NSynonyms
494217-84-4494217844
CCN1C=C(C=N1)C(=O)NC(=S)NC2=C(C3=C(S2)CCCCC3)C(=O)OCC
ethyl2((((1ethyl1Hpyrazol4yl)carbonyl)carbamothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((1ethylpyrazole4carbonyl)carbamothioylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC19H24N4O3S2c13231112(102023)16(24)2119(27)221715(18(25)2642)138657914(13)2817h1011H39H212H3(H221222427)
MFCD02374420
ZINC000000649475
ZINC00649475
ZINC649475
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