Vitas-M small molecule compound
(6Z)-1,3-dimethyl-6-(3-nitrobenzylidene)-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione
Catalog ID
STK744399
SMILES [O-][N+](=O)c1cccc(c1)/C=c/1\sc2=NC3(C(Nn2c1=O)(c1ccccc1)N(C(=O)N3C)C)c1ccccc1
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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 C27H22N6O4S MW 526.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N6O4S/c1-30-25(35)31(2)27(20-13-7-4-8-14-20)26(30,19-11-5-3-6-12-19)28-24-32(29-27)23(34)22(38-24)17-18-10-9-15-21(16-18)33(36)37/h3-17,29H,1-2H3/b22-17-InChIKey
VNKFZTBMPACPRI-XLNRJJMWSA-NSynonyms
(6Z)13dimethyl6(3nitrobenzylidene)3a9adiphenyl33a99atetrahydroimidazo(45e)(13)thiazolo(32b)(124)triazine27(1H6H)dione
(E)13dimethyl6(3nitrobenzylidene)3a9adiphenyl33a99atetrahydroimidazo(45e)thiazolo(32b)(124)triazine27(1H6H)dione
(O)(N+)(=O)c1cccc(c1)C=c1sc2=NC3(C(Nn2c1=O)(c1ccccc1)N(C(=O)N3C)C)c1ccccc1
CN1C(=O)N(C2(C1(NN3C(=O)C(=CC4=CC(=CC=C4)(N+)(=O)(O))SC3=N2)C5=CC=CC=C5)C6=CC=CC=C6)C
InChI=1SC27H22N6O4Sc13025(35)31(2)27(20137481420)26(3019115361219)282432(2927)23(34)22(3824)17181091521(1618)33(36)37h31729H12H3b2217
MFCD13371947
ZINC000001093954
ZINC000102688466
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