Vitas-M small molecule compound
(E)-1-(4-chlorophenyl)-N-(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-ylmethoxy)methanimine
Catalog ID
STK591308
SMILES Clc1ccc(cc1)/C=N/OCc1nc2n(n1)cnc1c2c2CCCCCc2s1
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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 C20H18ClN5OS MW 411.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN5OS/c21-14-8-6-13(7-9-14)10-23-27-11-17-24-19-18-15-4-2-1-3-5-16(15)28-20(18)22-12-26(19)25-17/h6-10,12H,1-5,11H2/b23-10+InChIKey
PPUSMWCWDWHXHP-AUEPDCJTSA-NSynonyms
902309-04-0(E)1(4chlorophenyl)N(9101112tetrahydro8Hcyclohepta(45)thieno(32e)(124)triazolo(15c)pyrimidin2ylmethoxy)methanimine
(E)4chlorobenzaldehydeO((9101112tetrahydro8Hcyclohepta(45)thieno(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
902309040
C1CCC2=C(CC1)SC3=C2C4=NC(=NN4C=N3)CON=CC5=CC=C(C=C5)Cl
Clc1ccc(cc1)C=NOCc1nc2n(n1)cnc1c2c2CCCCCc2s1
InChI=1SC20H18ClN5OSc21148613(7914)1023271117241918154213516(15)2820(18)221226(19)2517h61012H1511H2b2310+
MFCD06792748
ZINC000005349080
ZINC33526651
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