Vitas-M small molecule compound
4-ethyl 2-prop-2-en-1-yl 5-{[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK878441
SMILES C=CCOC(=O)c1sc(c(c1C)C(=O)OCC)NC=C1C(=O)NC(=S)NC1=O
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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 C17H17N3O6S2 MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O6S2/c1-4-6-26-16(24)11-8(3)10(15(23)25-5-2)14(28-11)18-7-9-12(21)19-17(27)20-13(9)22/h4,7,18H,1,5-6H2,2-3H3,(H2,19,20,21,22,27)InChIKey
NUJMUHFFADDBSA-UHFFFAOYSA-NSynonyms
2ALLYL4ETHYL5(((46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
4ethyl2prop2en1yl5(((46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)amino)3methylthiophene24dicarboxylate
4Oethyl2Oprop2enyl5((46dioxo2sulfanylidene13diazinan5ylidene)methylamino)3methylthiophene24dicarboxylate
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC=C)NC=C2C(=O)NC(=S)NC2=O
InChI=1SC17H17N3O6S2c1462616(24)118(3)10(15(23)2552)14(2811)187912(21)1917(27)2013(9)22h4718H156H223H3(H21920212227)
MFCD11992834
ZINC000017297268
ZINC17297268
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