Vitas-M small molecule compound
(2E,9E)-9-(4-ethoxybenzylidene)-5-(4-ethoxyphenyl)-2-(4-nitrobenzylidene)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Catalog ID
STL115180
SMILES CCOc1ccc(cc1)C1C2=C(N=c3n1c(=O)/c(=C\c1ccc(cc1)[N+](=O)[O-])/s3)/C(=C/c1ccc(cc1)OCC)/CCC2
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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 C34H31N3O5S MW 593.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31N3O5S/c1-3-41-27-16-10-22(11-17-27)20-25-6-5-7-29-31(25)35-34-36(32(29)24-12-18-28(19-13-24)42-4-2)33(38)30(43-34)21-23-8-14-26(15-9-23)37(39)40/h8-21,32H,3-7H2,1-2H3/b25-20+,30-21+InChIKey
BZSFYMQPIWTMQK-NEYSBOPRSA-NSynonyms
(2E9E)5(4ethoxyphenyl)9((4ethoxyphenyl)methylidene)2((4nitrophenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazolin3one
(2E9E)9(4ethoxybenzylidene)5(4ethoxyphenyl)2(4nitrobenzylidene)6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
CCOC1=CC=C(C=C1)C=C2CCCC3=C2N=C4N(C3C5=CC=C(C=C5)OCC)C(=O)C(=CC6=CC=C(C=C6)(N+)(=O)(O))S4
CCOc1ccc(cc1)C1C2=C(N=c3n1c(=O)c(=Cc1ccc(cc1)(N+)(=O)(O))s3)C(=Cc1ccc(cc1)OCC)CCC2
InChI=1SC34H31N3O5Sc134127161022(111727)20256572931(25)353436(32(29)24121828(191324)4242)33(38)30(4334)212381426(15923)37(39)40h82132H37H212H3b2520+3021+
MFCD06326627
ZINC000102901935
ZINC000102901937
Check stock
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