Vitas-M small molecule compound

2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-[4-(pyrrolidin-1-ylsulfonyl)phenyl]acetamide

Catalog ID
STK031030
SMILES O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)Nc1ccc(cc1)S(=O)(=O)N1CCCC1

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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 C19H22N6O5S MW 446.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N6O5S/c1-22-17-16(18(27)23(2)19(22)28)24(12-20-17)11-15(26)21-13-5-7-14(8-6-13)31(29,30)25-9-3-4-10-25/h5-8,12H,3-4,9-11H2,1-2H3,(H,21,26)
InChIKey
KDZNUMNJHWSECS-UHFFFAOYSA-N
Synonyms
510736-24-0
2(13DIMETHYL26DIOXO(137TRIHYDROPURIN7YL))N(4(PYRROLIDINYLSULFONYL)PHENYL)ACETAMIDE
2(13dimethyl26dioxo1236tetrahydro7Hpurin7yl)N(4(pyrrolidin1ylsulfonyl)phenyl)acetamide
2(13DIMETHYL26DIOXOPURIN7YL)N(4PYRROLIDIN1YLSULFONYLPHENYL)ACETAMIDE
510736240
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4
InChI=1SC19H22N6O5Sc1221716(18(27)23(2)19(22)28)24(122017)1115(26)21135714(8613)31(2930)259341025h5812H34911H212H3(H2126)
MFCD03351904
O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)Nc1ccc(cc1)S(=O)(=O)N1CCCC1
STK031030
ZINC000000789913
ZINC00789913
ZINC789913

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Available files

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