Vitas-M small molecule compound
2-{4-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL395049
SMILES [O-][N+](=O)c1cnn(c1)Cc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)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 C22H15N9O2 MW 437.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15N9O2/c32-31(33)18-10-24-28(13-18)12-15-6-8-16(9-7-15)20-26-22-19-11-25-30(17-4-2-1-3-5-17)21(19)23-14-29(22)27-20/h1-11,13-14H,12H2InChIKey
CUNRSHLPZABOQC-UHFFFAOYSA-NSynonyms
1005589-63-8(O)(N+)(=O)c1cnn(c1)Cc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1ccccc1
1005589638
2(4((4NITRO1HPYRAZOL1YL)METHYL)PHENYL)7PHENYL7HPYRAZOLO(43E)(124)TRIAZOLO(15C)PYRIMIDINE
C1=CC=C(C=C1)N2C3=C(C=N2)C4=NC(=NN4C=N3)C5=CC=C(C=C5)CN6C=C(C=N6)(N+)(=O)(O)
InChI=1SC22H15N9O2c3231(33)18102428(1318)12156816(9715)20262219112530(174213517)21(19)231429(22)2720h1111314H12H2
MFCD04133775
ZINC000002800554
ZINC02800554
ZINC2800554
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