Vitas-M small molecule compound
N-(4-chlorobenzyl)-4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)butanamide
Catalog ID
STL135100
SMILES CCn1c2nnc(n2c2c(c1=O)scc2)CCCC(=O)NCc1ccc(cc1)Cl
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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 C20H20ClN5O2S MW 429.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN5O2S/c1-2-25-19(28)18-15(10-11-29-18)26-16(23-24-20(25)26)4-3-5-17(27)22-12-13-6-8-14(21)9-7-13/h6-11H,2-5,12H2,1H3,(H,22,27)InChIKey
IZBAMCGYITXIDW-UHFFFAOYSA-NSynonyms
CCN1C(=O)C2=C(C=CS2)N3C1=NN=C3CCCC(=O)NCC4=CC=C(C=C4)Cl
InChI=1SC20H20ClN5O2Sc122519(28)1815(10112918)2616(232420(25)26)43517(27)2212136814(21)9713h611H2512H21H3(H2227)
MFCD14902203
N(4chlorobenzyl)4(4ethyl5oxo45dihydrothieno(23e)(124)triazolo(43a)pyrimidin1yl)butanamide
ZINC000009431380
ZINC9431380
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