Vitas-M small molecule compound
N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Catalog ID
STK665261
SMILES COc1cc(NC(=O)CSc2nnc(s2)C)c(cc1OC)Cc1nccc2c1cc(OC)c(c2)OC
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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 C25H26N4O5S2 MW 526.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O5S2/c1-14-28-29-25(36-14)35-13-24(30)27-18-12-23(34-5)21(32-3)10-16(18)8-19-17-11-22(33-4)20(31-2)9-15(17)6-7-26-19/h6-7,9-12H,8,13H2,1-5H3,(H,27,30)InChIKey
UDQIKRXJCGFSQE-UHFFFAOYSA-NSynonyms
CC1=NN=C(S1)SCC(=O)NC2=CC(=C(C=C2CC3=NC=CC4=CC(=C(C=C43)OC)OC)OC)OC
InChI=1SC25H26N4O5S2c114282925(3614)351324(30)27181223(345)21(323)1016(18)819171122(334)20(312)915(17)672619h67912H813H215H3(H2730)
MFCD08142706
N(2((67dimethoxyisoquinolin1yl)methyl)45dimethoxyphenyl)2((5methyl134thiadiazol2yl)sulfanyl)acetamide
ZINC000098048350
ZINC98048350
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