Vitas-M small molecule compound
{(1S,2R,3S)-2-[4-(dimethylamino)phenyl]-1-nitro-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazin-3-yl}(phenyl)methanone
Catalog ID
STK541889
SMILES O=C([C@H]1N2N=Cc3c(C2[C@H]([C@@H]1c1ccc(cc1)N(C)C)[N+](=O)[O-])cccc3)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 C26H24N4O3 MW 440.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O3/c1-28(2)20-14-12-17(13-15-20)22-24(30(32)33)23-21-11-7-6-10-19(21)16-27-29(23)25(22)26(31)18-8-4-3-5-9-18/h3-16,22-25H,1-2H3/t22-,23?,24-,25-/m0/s1InChIKey
PRAVMSFPXRPZKR-MHKFTUFMSA-NSynonyms
1014058-88-8((1S2R3S)2(4(dimethylamino)phenyl)1nitro12310btetrahydropyrrolo(21a)phthalazin3yl)(phenyl)methanone
((1S2R3S)2(4(dimethylamino)phenyl)1nitro12310btetrahydropyrrolo(21a)phthalazin3yl)phenylmethanone
1014058888
CN(C)C1=CC=C(C=C1)C2C(C3C4=CC=CC=C4C=NN3C2C(=O)C5=CC=CC=C5)(N+)(=O)(O)
InChI=1SC26H24N4O3c128(2)20141217(131520)2224(30(32)33)232111761019(21)162729(23)25(22)26(31)188435918h3162225H12H3t2223?2425m0s1
MFCD18241940
O=C((C@H)1N2N=Cc3c(C2(C@H)((C@@H)1c1ccc(cc1)N(C)C)(N+)(=O)(O))cccc3)c1ccccc1
ZINC000009007682
ZINC000009357315
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