Vitas-M small molecule compound
(7Z)-3-(3,5-dimethylphenyl)-7-(4-nitrobenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Catalog ID
STK859918
SMILES Cc1cc(C)cc(c1)N1CN=c2n(C1)c(=O)/c(=C/c1ccc(cc1)[N+](=O)[O-])/s2
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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 C20H18N4O3S MW 394.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O3S/c1-13-7-14(2)9-17(8-13)22-11-21-20-23(12-22)19(25)18(28-20)10-15-3-5-16(6-4-15)24(26)27/h3-10H,11-12H2,1-2H3/b18-10-InChIKey
XTKGJKNETRIGSN-ZDLGFXPLSA-NSynonyms
500194-87-6(7Z)3(35DIMETHYLPHENYL)7((4NITROPHENYL)METHYLIDENE)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(7Z)3(35dimethylphenyl)7(4nitrobenzylidene)34dihydro2H(13)thiazolo(32a)(135)triazin6(7H)one
(Z)3(35dimethylphenyl)7(4nitrobenzylidene)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
500194876
CC1=CC(=CC(=C1)N2CN=C3N(C2)C(=O)C(=CC4=CC=C(C=C4)(N+)(=O)(O))S3)C
Cc1cc(C)cc(c1)N1CN=c2n(C1)c(=O)c(=Cc1ccc(cc1)(N+)(=O)(O))s2
InChI=1SC20H18N4O3Sc113714(2)917(813)2211212023(1222)19(25)18(2820)10153516(6415)24(26)27h310H1112H212H3b1810
MFCD03304824
ZINC000002360416
ZINC02360416
ZINC2360416
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