Vitas-M small molecule compound
(5Z)-2-[(E)-2-(4-methylphenyl)ethenyl]-5-(4-nitrobenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK800071
SMILES Cc1ccc(cc1)/C=C/c1nn2c(n1)s/c(=C\c1ccc(cc1)[N+](=O)[O-])/c2=O
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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 C20H14N4O3S MW 390.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N4O3S/c1-13-2-4-14(5-3-13)8-11-18-21-20-23(22-18)19(25)17(28-20)12-15-6-9-16(10-7-15)24(26)27/h2-12H,1H3/b11-8+,17-12-InChIKey
JUXDRJBUHXGWJL-JUBDITTISA-NSynonyms
(5Z)2((E)2(4METHYLPHENYL)ETHENYL)5((4NITROPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)2((E)2(4methylphenyl)ethenyl)5(4nitrobenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
2((E)4METHYLSTYRYL)5((Z)4NITROBENZYLIDENE)THIAZOLO(32B)(124)TRIAZOL6(5H)ONE
CC1=CC=C(C=C1)C=CC2=NN3C(=O)C(=CC4=CC=C(C=C4)(N+)(=O)(O))SC3=N2
Cc1ccc(cc1)C=Cc1nn2c(n1)sc(=Cc1ccc(cc1)(N+)(=O)(O))c2=O
InChI=1SC20H14N4O3Sc1132414(5313)81118212023(2218)19(25)17(2820)12156916(10715)24(26)27h212H1H3b118+1712
MFCD04447043
ZINC000004318633
ZINC04318633
ZINC4318633
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