Vitas-M small molecule compound

3-(3,4-dichlorophenyl)-1-[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium

Catalog ID
STL050479
SMILES O=C(N1c2ccccc2Sc2c1cccc2)Cn1cc([n+]2c1CCC2)c1ccc(c(c1)Cl)Cl

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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 C26H20Cl2N3OS MW 493.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20Cl2N3OS/c27-18-12-11-17(14-19(18)28)22-15-29(25-10-5-13-30(22)25)16-26(32)31-20-6-1-3-8-23(20)33-24-9-4-2-7-21(24)31/h1-4,6-9,11-12,14-15H,5,10,13,16H2/q+1
InChIKey
BONOZTUZIIWFQU-UHFFFAOYSA-N
Synonyms

2(3(34DICHLOROPHENYL)67DIHYDRO5HPYRROL(12A)IMIDAZOL1IUM1YL)1PHENOTHIAZIN10YLETHANONECHLORIDE
2(3(34DICHLOROPHENYL)67DIHYDRO5HPYRROLO(12A)IMIDAZOL1IUM1YL)1(10PHENOTHIAZINYL)ETHANONECHLORIDE
2(3(34DICHLOROPHENYL)67DIHYDRO5HPYRROLO(12A)IMIDAZOL1IUM1YL)1PHENOTHIAZIN10YLETHANONE
2(3(34DICHLOROPHENYL)67DIHYDRO5HPYRROLO(12A)IMIDAZOL1IUM1YL)1PHENOTHIAZIN10YLETHANONECHLORIDE
3(34dichlorophenyl)1(2oxo2(10Hphenothiazin10yl)ethyl)1567tetrahydropyrrolo(12a)imidazol4ium
3(34DICHLOROPHENYL)1(2OXO2PHENOTHIAZIN10YLETHYL)67DIHYDRO5HPYRROLO(12A)IMIDAZOL1IUM
C1CC2=(N+)(C=C(N2C1)C3=CC(=C(C=C3)Cl)Cl)CC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64
InChI=1SC26H20Cl2N3OSc2718121117(1419(18)28)221529(251051330(22)25)1626(32)3120613823(20)3324942721(24)31h146911121415H5101316H2q+1
O=C(N1c2ccccc2Sc2c1cccc2)Cn1cc((n+)2c1CCC2)c1ccc(c(c1)Cl)Cl
ZINC000016956556
ZINC16956556

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Available files

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