Vitas-M small molecule compound
ethyl 2-[(diprop-2-en-1-ylcarbamothioyl)amino]-5-phenylthiophene-3-carboxylate
Catalog ID
STK456539
SMILES C=CCN(C(=S)Nc1sc(cc1C(=O)OCC)c1ccccc1)CC=C
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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 C20H22N2O2S2 MW 386.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O2S2/c1-4-12-22(13-5-2)20(25)21-18-16(19(23)24-6-3)14-17(26-18)15-10-8-7-9-11-15/h4-5,7-11,14H,1-2,6,12-13H2,3H3,(H,21,25)InChIKey
BLQFQLVJYRYOGP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N(CC=C)CC=C
ETHYL2(((DIPROP2ENYLAMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ethyl2((diprop2en1ylcarbamothioyl)amino)5phenylthiophene3carboxylate
ETHYL2(BIS(PROP2ENYL)CARBAMOTHIOYLAMINO)5PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC20H22N2O2S2c141222(1352)20(25)211816(19(23)2463)1417(2618)15108791115h4571114H1261213H23H3(H2125)
MFCD05989326
ZINC000002852353
ZINC02852353
ZINC2852353
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