Vitas-M small molecule compound
N~4~-benzyl-N~2~-(4-methylbenzyl)-5-nitropyrimidine-2,4,6-triamine
Catalog ID
STK558598
SMILES Cc1ccc(cc1)CNc1nc(NCc2ccccc2)c(c(n1)N)[N+](=O)[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 C19H20N6O2 MW 364.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N6O2/c1-13-7-9-15(10-8-13)12-22-19-23-17(20)16(25(26)27)18(24-19)21-11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H4,20,21,22,23,24)InChIKey
TYJHRWZPZPJPOS-UHFFFAOYSA-NSynonyms
587010-80-8(6AMINO2(((4METHYLPHENYL)METHYL)AMINO)5NITROPYRIMIDIN4YL)BENZYLAMINE
4NBENZYL2N((4METHYLPHENYL)METHYL)5NITROPYRIMIDINE246TRIAMINE
587010808
CC1=CC=C(C=C1)CNC2=NC(=C(C(=N2)NCC3=CC=CC=C3)(N+)(=O)(O))N
Cc1ccc(cc1)CNc1nc(NCc2ccccc2)c(c(n1)N)(N+)(=O)(O)
InChI=1SC19H20N6O2c1137915(10813)1222192317(20)16(25(26)27)18(2419)2111145324614h210H1112H21H3(H42021222324)
MFCD03491769
N~4~benzylN~2~(4methylbenzyl)5nitropyrimidine246triamine
N4BENZYLN2(4METHYLBENZYL)5NITROPYRIMIDINE246TRIAMINE
NBENZYLN(4METHYLBENZYL)5NITROPYRIMIDINE246TRIAMINE
ZINC000005119900
ZINC05119900
ZINC5119900
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