Vitas-M small molecule compound
N-(2-chlorobenzyl)-6-{1-[2-(diethylamino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}hexanamide
Catalog ID
STL145573
SMILES CCN(C(=O)Cn1c2ccsc2c(=O)n(c1=O)CCCCCC(=O)NCc1ccccc1Cl)CC
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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 C25H31ClN4O4S MW 519.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31ClN4O4S/c1-3-28(4-2)22(32)17-30-20-13-15-35-23(20)24(33)29(25(30)34)14-9-5-6-12-21(31)27-16-18-10-7-8-11-19(18)26/h7-8,10-11,13,15H,3-6,9,12,14,16-17H2,1-2H3,(H,27,31)InChIKey
NYUPJQJVDUKVBA-UHFFFAOYSA-NSynonyms
912884-84-5912884845
CCN(CC)C(=O)CN1C2=C(C(=O)N(C1=O)CCCCCC(=O)NCC3=CC=CC=C3Cl)SC=C2
InChI=1SC25H31ClN4O4Sc1328(42)22(32)17302013153523(20)24(33)29(25(30)34)149561221(31)27161810781119(18)26h7810111315H36912141617H212H3(H2731)
MFCD14734574
N((2chlorophenyl)methyl)6(1(2(diethylamino)2oxoethyl)24dioxothieno(32d)pyrimidin3yl)hexanamide
N(2chlorobenzyl)6(1(2(diethylamino)2oxoethyl)24dioxo14dihydrothieno(32d)pyrimidin3(2H)yl)hexanamide
ZINC000008593210
ZINC8593210
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