Vitas-M small molecule compound
(10E)-10-(anthracen-9-ylmethylidene)-7-(3-nitrophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK742969
SMILES O=c1/c(=C\c2c3ccccc3cc3c2cccc3)/sc2=NC3=C(C(n12)c1cccc(c1)[N+](=O)[O-])CCc1c3cccc1
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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 C35H23N3O3S MW 565.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H23N3O3S/c39-34-31(20-30-26-13-4-2-9-22(26)18-23-10-3-5-14-27(23)30)42-35-36-32-28-15-6-1-8-21(28)16-17-29(32)33(37(34)35)24-11-7-12-25(19-24)38(40)41/h1-15,18-20,33H,16-17H2/b31-20+InChIKey
VGQQPUVZNWSLKA-AJBULDERSA-NSynonyms
(10E)10(anthracen9ylmethylidene)7(3nitrophenyl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(Z)10(anthracen9ylmethylene)7(3nitrophenyl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC(=CC=C5)(N+)(=O)(O))C(=O)C(=CC6=C7C=CC=CC7=CC8=CC=CC=C86)S4
InChI=1SC35H23N3O3Sc393431(2030261342922(26)182310351427(23)30)42353632281561821(28)161729(32)33(37(34)35)241171225(1924)38(40)41h115182033H1617H2b3120+
MFCD03548517
O=c1c(=Cc2c3ccccc3cc3c2cccc3)sc2=NC3=C(C(n12)c1cccc(c1)(N+)(=O)(O))CCc1c3cccc1
ZINC000100954057
ZINC000100954059
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