Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-6-[1-(4-chlorobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamide
Catalog ID
STL145605
SMILES O=C(NCc1ccc2c(c1)OCO2)CCCCCn1c(=O)n(Cc2ccc(cc2)Cl)c2c(c1=O)scc2
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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 C27H26ClN3O5S MW 540.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O5S/c28-20-8-5-18(6-9-20)16-31-21-11-13-37-25(21)26(33)30(27(31)34)12-3-1-2-4-24(32)29-15-19-7-10-22-23(14-19)36-17-35-22/h5-11,13-14H,1-4,12,15-17H2,(H,29,32)InChIKey
YLWKROMNOUVTPQ-UHFFFAOYSA-NSynonyms
866013-35-6866013356
C1OC2=C(O1)C=C(C=C2)CNC(=O)CCCCCN3C(=O)C4=C(C=CS4)N(C3=O)CC5=CC=C(C=C5)Cl
InChI=1SC27H26ClN3O5Sc28208518(6920)16312111133725(21)26(33)30(27(31)34)12312424(32)2915197102223(1419)36173522h5111314H14121517H2(H2932)
MFCD04445102
N(13BENZODIOXOL5YLMETHYL)6(1((4CHLOROPHENYL)METHYL)24DIOXOTHIENO(32D)PYRIMIDIN3YL)HEXANAMIDE
N(13benzodioxol5ylmethyl)6(1(4chlorobenzyl)24dioxo14dihydrothieno(32d)pyrimidin3(2H)yl)hexanamide
N(BENZO(D)(13)DIOXOL5YLMETHYL)6(1(4CHLOROBENZYL)24DIOXO12DIHYDROTHIENO(32D)PYRIMIDIN3(4H)YL)HEXANAMIDE
ZINC000002687311
ZINC2687311
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