Vitas-M small molecule compound
4-(3-methylbutyl)-1-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STL135120
SMILES CC(CCn1c2nnc(n2c2c(c1=O)scc2)CCCC(=O)N1CCN(CC1)c1ccccc1)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 C26H32N6O2S MW 492.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N6O2S/c1-19(2)11-13-31-25(34)24-21(12-18-35-24)32-22(27-28-26(31)32)9-6-10-23(33)30-16-14-29(15-17-30)20-7-4-3-5-8-20/h3-5,7-8,12,18-19H,6,9-11,13-17H2,1-2H3InChIKey
OUYFTCDQPSMUFU-UHFFFAOYSA-NSynonyms
4(3methylbutyl)1(4oxo4(4phenylpiperazin1yl)butyl)thieno(23e)(124)triazolo(43a)pyrimidin5(4H)one
CC(C)CCN1C(=O)C2=C(C=CS2)N3C1=NN=C3CCCC(=O)N4CCN(CC4)C5=CC=CC=C5
InChI=1SC26H32N6O2Sc119(2)11133125(34)2421(12183524)3222(272826(31)32)961023(33)30161429(151730)207435820h3578121819H69111317H212H3
MFCD06745345
ZINC000009118942
ZINC09118942
ZINC9118942
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