Vitas-M small molecule compound
(8E)-8-benzylidene-2-(2-chlorophenyl)-12-phenyl-8,10,11,12-tetrahydro-9H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL173404
SMILES Clc1ccccc1c1nn2c(n1)c1c(nc2)OC2=C(C1c1ccccc1)CCC/C/2=C\c1ccccc1
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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 C31H23ClN4O MW 503.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23ClN4O/c32-25-17-8-7-15-23(25)29-34-30-27-26(21-12-5-2-6-13-21)24-16-9-14-22(18-20-10-3-1-4-11-20)28(24)37-31(27)33-19-36(30)35-29/h1-8,10-13,15,17-19,26H,9,14,16H2/b22-18+InChIKey
FIQAVRWPXLXOTN-RELWKKBWSA-NSynonyms
866817-66-5(8E)8benzylidene2(2chlorophenyl)12phenyl8101112tetrahydro9Hchromeno(32e)(124)triazolo(15c)pyrimidine
866817665
C1CC(=CC2=CC=CC=C2)C3=C(C1)C(C4=C(O3)N=CN5C4=NC(=N5)C6=CC=CC=C6Cl)C7=CC=CC=C7
Clc1ccccc1c1nn2c(n1)c1c(nc2)OC2=C(C1c1ccccc1)CCCC2=Cc1ccccc1
InChI=1SC31H23ClN4Oc322517871523(25)2934302726(21125261321)241691422(1820103141120)28(24)3731(27)331936(30)3529h18101315171926H91416H2b2218+
MFCD06196982
ZINC000013643556
ZINC000013643559
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