Vitas-M small molecule compound
ethyl 2-{[(2,6-dimethylpiperidin-1-yl)carbonothioyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK438481
SMILES CCOC(=O)c1c(NC(=S)N2C(C)CCCC2C)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 C20H30N2O2S2 MW 394.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H30N2O2S2/c1-4-24-19(23)17-15-11-6-5-7-12-16(15)26-18(17)21-20(25)22-13(2)9-8-10-14(22)3/h13-14H,4-12H2,1-3H3,(H,21,25)InChIKey
IPZTYZCJZSTMQT-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=S)N3C(CCCC3C)C
ethyl2(((26dimethylpiperidin1yl)carbonothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((26dimethylpiperidine1carbothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC20H30N2O2S2c142419(23)1715116571216(15)2618(17)2120(25)2213(2)981014(22)3h1314H412H213H3(H2125)
MFCD03945400
ZINC000005979982
ZINC000017080713
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