Vitas-M small molecule compound
(7Z)-3-(4-methoxyphenyl)-7-(3-nitrobenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Catalog ID
STL352635
SMILES COc1ccc(cc1)N1CN=c2n(C1)c(=O)/c(=C/c1cccc(c1)[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 C19H16N4O4S MW 396.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O4S/c1-27-16-7-5-14(6-8-16)21-11-20-19-22(12-21)18(24)17(28-19)10-13-3-2-4-15(9-13)23(25)26/h2-10H,11-12H2,1H3/b17-10-InChIKey
VMACFHVUFHJONB-YVLHZVERSA-NSynonyms
(7Z)3(4METHOXYPHENYL)7((3NITROPHENYL)METHYLIDENE)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(7Z)3(4methoxyphenyl)7(3nitrobenzylidene)34dihydro2H(13)thiazolo(32a)(135)triazin6(7H)one
(Z)3(4methoxyphenyl)7(3nitrobenzylidene)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
COC1=CC=C(C=C1)N2CN=C3N(C2)C(=O)C(=CC4=CC(=CC=C4)(N+)(=O)(O))S3
COc1ccc(cc1)N1CN=c2n(C1)c(=O)c(=Cc1cccc(c1)(N+)(=O)(O))s2
InChI=1SC19H16N4O4Sc127167514(6816)2111201922(1221)18(24)17(2819)101332415(913)23(25)26h210H1112H21H3b1710
MFCD02993217
ZINC000002299788
ZINC02299788
ZINC2299788
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