Vitas-M small molecule compound
7-benzyl-1,3-dimethyl-2,4-dioxo-N-(2-oxotetrahydrothiophen-3-yl)-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidine-6-carboxamide
Catalog ID
STK979146
SMILES O=C1SCCC1NC(=O)c1cc2c(n1Cc1ccccc1)n(C)c(=O)n(c2=O)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 C20H20N4O4S MW 412.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O4S/c1-22-17-13(18(26)23(2)20(22)28)10-15(16(25)21-14-8-9-29-19(14)27)24(17)11-12-6-4-3-5-7-12/h3-7,10,14H,8-9,11H2,1-2H3,(H,21,25)InChIKey
GKBNQCBUEMHBBG-UHFFFAOYSA-NSynonyms
1171480-89-91171480899
7benzyl13dimethyl24dioxoN(2oxotetrahydrothiophen3yl)2347tetrahydro1Hpyrrolo(23d)pyrimidine6carboxamide
7benzyl13dimethyl24dioxoN(2oxothiolan3yl)pyrrolo(23d)pyrimidine6carboxamide
CN1C2=C(C=C(N2CC3=CC=CC=C3)C(=O)NC4CCSC4=O)C(=O)N(C1=O)C
InChI=1SC20H20N4O4Sc1221713(18(26)23(2)20(22)28)1015(16(25)2114892919(14)27)24(17)11126435712h371014H8911H212H3(H2125)
MFCD12006877
ZINC000011845115
ZINC000011845116
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