Vitas-M small molecule compound
ethyl 6-benzyl-2-[(prop-2-en-1-ylcarbamothioyl)amino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Catalog ID
STK035080
SMILES C=CCNC(=S)Nc1sc2c(c1C(=O)OCC)CCN(C2)Cc1ccccc1
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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 C21H25N3O2S2 MW 415.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O2S2/c1-3-11-22-21(27)23-19-18(20(25)26-4-2)16-10-12-24(14-17(16)28-19)13-15-8-6-5-7-9-15/h3,5-9H,1,4,10-14H2,2H3,(H2,22,23,27)InChIKey
RVBYWEFZVXQPOJ-UHFFFAOYSA-NSynonyms
102623-30-3102623303
C=CCNC(=S)Nc1sc2c(c1C(=O)OCC)CCN(C2)Cc1ccccc1
CCOC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)NC(=S)NCC=C
ethyl2(3allylthioureido)6benzyl4567tetrahydrothieno(23c)pyridine3carboxylate
ethyl6benzyl2((prop2en1ylcarbamothioyl)amino)4567tetrahydrothieno(23c)pyridine3carboxylate
ETHYL6BENZYL2(PROP2ENYLCARBAMOTHIOYLAMINO)57DIHYDRO4HTHIENO(23C)PYRIDINE3CARBOXYLATE
InChI=1SC21H25N3O2S2c13112221(27)231918(20(25)2642)16101224(1417(16)2819)13158657915h359H141014H22H3(H2222327)
MFCD00667041
STK035080
ZINC000020219695
ZINC20219695
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