Vitas-M small molecule compound
(1Z)-1-(4-methoxyphenyl)-N-(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-ylmethoxy)ethanimine
Catalog ID
STK111400
SMILES COc1ccc(cc1)/C(=N\OCc1nc2n(n1)cnc1c2c2CCCCCc2s1)/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 C22H23N5O2S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O2S/c1-14(15-8-10-16(28-2)11-9-15)26-29-12-19-24-21-20-17-6-4-3-5-7-18(17)30-22(20)23-13-27(21)25-19/h8-11,13H,3-7,12H2,1-2H3/b26-14-InChIKey
NVNJMFVZNOUZNV-WGARJPEWSA-NSynonyms
736971-95-2(1Z)1(4methoxyphenyl)N(9101112tetrahydro8Hcyclohepta(45)thieno(32e)(124)triazolo(15c)pyrimidin2ylmethoxy)ethanimine
(Z)1(4methoxyphenyl)ethanoneO((9101112tetrahydro8Hcyclohepta(45)thieno(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
736971952
CC(=NOCC1=NN2C=NC3=C(C2=N1)C4=C(S3)CCCCC4)C5=CC=C(C=C5)OC
COc1ccc(cc1)C(=NOCc1nc2n(n1)cnc1c2c2CCCCCc2s1)C
InChI=1SC22H23N5O2Sc114(1581016(282)11915)26291219242120176435718(17)3022(20)231327(21)2519h81113H3712H212H3b2614
MFCD04006849
ZINC000004689280
ZINC34367742
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