Vitas-M small molecule compound
4-(2-{[1,3-dimethyl-7-(4-methylbenzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]amino}ethyl)benzenesulfonamide
Catalog ID
STK262544
SMILES Cc1ccc(cc1)Cn1c(NCCc2ccc(cc2)S(=O)(=O)N)nc2c1c(=O)n(c(=O)n2C)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 C23H26N6O4S MW 482.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N6O4S/c1-15-4-6-17(7-5-15)14-29-19-20(27(2)23(31)28(3)21(19)30)26-22(29)25-13-12-16-8-10-18(11-9-16)34(24,32)33/h4-11H,12-14H2,1-3H3,(H,25,26)(H2,24,32,33)InChIKey
HDITUNGTNPIMKU-UHFFFAOYSA-NSynonyms
4(2((13DIMETHYL7((4METHYLPHENYL)METHYL)26DIOXO137TRIHYDROPURIN8YL)AMINO)ETHYL)BENZENESULFONAMIDE
4(2((13DIMETHYL7((4METHYLPHENYL)METHYL)26DIOXOPURIN8YL)AMINO)ETHYL)BENZENESULFONAMIDE
4(2((13dimethyl7(4methylbenzyl)26dioxo2367tetrahydro1Hpurin8yl)amino)ethyl)benzenesulfonamide
CC1=CC=C(C=C1)CN2C3=C(N=C2NCCC4=CC=C(C=C4)S(=O)(=O)N)N(C(=O)N(C3=O)C)C
InChI=1SC23H26N6O4Sc1154617(7515)14291920(27(2)23(31)28(3)21(19)30)2622(29)2513121681018(11916)34(2432)33h411H1214H213H3(H2526)(H2243233)
MFCD07621006
ZINC000008774900
ZINC08774900
ZINC8774900
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