Vitas-M small molecule compound
methyl 2-{[(1H-pyrazol-3-ylmethyl)carbamothioyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK439865
SMILES COC(=O)c1c(NC(=S)NCc2cc[nH]n2)sc2c1CCC2
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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 C14H16N4O2S2 MW 336.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4O2S2/c1-20-13(19)11-9-3-2-4-10(9)22-12(11)17-14(21)15-7-8-5-6-16-18-8/h5-6H,2-4,7H2,1H3,(H,16,18)(H2,15,17,21)InChIKey
QUIYDAQTGYLBKA-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCC2)NC(=S)NCC3=CC=NN3
COC(=O)c1c(NC(=S)NCc2cc(nH)n2)sc2c1CCC2
InChI=1SC14H16N4O2S2c12013(19)11932410(9)2212(11)1714(21)15785616188h56H247H21H3(H1618)(H2151721)
METHYL2((((PYRAZOL3YLMETHYL)AMINO)THIOXOMETHYL)AMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
methyl2(((1Hpyrazol3ylmethyl)carbamothioyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2(1HPYRAZOL5YLMETHYLCARBAMOTHIOYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD03946056
ZINC000005929146
ZINC05929146
ZINC5929146
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