Vitas-M small molecule compound
methyl 2-{[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-5-[(2-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate
Catalog ID
STK878436
SMILES COC(=O)c1c(NC=C2C(=O)NC(=S)NC2=O)sc(c1C)C(=O)Nc1ccccc1OC
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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 C20H18N4O6S2 MW 474.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O6S2/c1-9-13(19(28)30-3)18(21-8-10-15(25)23-20(31)24-16(10)26)32-14(9)17(27)22-11-6-4-5-7-12(11)29-2/h4-8,21H,1-3H3,(H,22,27)(H2,23,24,25,26,31)InChIKey
KYOSNCCLDMPABC-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC=C2C(=O)NC(=S)NC2=O)C(=O)NC3=CC=CC=C3OC
InChI=1SC20H18N4O6S2c1913(19(28)303)18(2181015(25)2320(31)2416(10)26)3214(9)17(27)2211645712(11)292h4821H13H3(H2227)(H22324252631)
methyl2(((46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)amino)5((2methoxyphenyl)carbamoyl)4methylthiophene3carboxylate
methyl2((46dioxo2sulfanylidene13diazinan5ylidene)methylamino)5((2methoxyphenyl)carbamoyl)4methylthiophene3carboxylate
MFCD18170304
ZINC000040476931
ZINC40476931
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