Vitas-M small molecule compound
(2E,9E)-9-[4-(dimethylamino)benzylidene]-5-[4-(dimethylamino)phenyl]-2-(4-nitrobenzylidene)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Catalog ID
STL115189
SMILES CN(c1ccc(cc1)C1C2=C(N=c3n1c(=O)/c(=C\c1ccc(cc1)[N+](=O)[O-])/s3)/C(=C/c1ccc(cc1)N(C)C)/CCC2)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 C34H33N5O3S MW 591.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H33N5O3S/c1-36(2)26-14-8-22(9-15-26)20-25-6-5-7-29-31(25)35-34-38(32(29)24-12-18-27(19-13-24)37(3)4)33(40)30(43-34)21-23-10-16-28(17-11-23)39(41)42/h8-21,32H,5-7H2,1-4H3/b25-20+,30-21+InChIKey
ZWRVKQAUMRFKSU-NEYSBOPRSA-NSynonyms
(2E9E)5(4(dimethylamino)phenyl)9((4(dimethylamino)phenyl)methylidene)2((4nitrophenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazolin3one
(2E9E)9(4(dimethylamino)benzylidene)5(4(dimethylamino)phenyl)2(4nitrobenzylidene)6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
CN(C)C1=CC=C(C=C1)C=C2CCCC3=C2N=C4N(C3C5=CC=C(C=C5)N(C)C)C(=O)C(=CC6=CC=C(C=C6)(N+)(=O)(O))S4
CN(c1ccc(cc1)C1C2=C(N=c3n1c(=O)c(=Cc1ccc(cc1)(N+)(=O)(O))s3)C(=Cc1ccc(cc1)N(C)C)CCC2)C
InChI=1SC34H33N5O3Sc136(2)2614822(91526)20256572931(25)353438(32(29)24121827(191324)37(3)4)33(40)30(4334)2123101628(171123)39(41)42h82132H57H214H3b2520+3021+
MFCD03177146
ZINC000103145610
ZINC000104849166
Check stock
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