Vitas-M small molecule compound
3-methyl-N-({5-[(2-nitrobenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazol-3-yl}methyl)benzamide
Catalog ID
STK246093
SMILES Cc1cccc(c1)C(=O)NCc1nnc(n1c1ccccc1)SCc1ccccc1[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 C24H21N5O3S MW 459.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N5O3S/c1-17-8-7-10-18(14-17)23(30)25-15-22-26-27-24(28(22)20-11-3-2-4-12-20)33-16-19-9-5-6-13-21(19)29(31)32/h2-14H,15-16H2,1H3,(H,25,30)InChIKey
PQNXVFPXFGBYFT-UHFFFAOYSA-NSynonyms
3methylN((5((2nitrobenzyl)sulfanyl)4phenyl4H124triazol3yl)methyl)benzamide
3methylN((5((2nitrophenyl)methylsulfanyl)4phenyl124triazol3yl)methyl)benzamide
3METHYLN(5(2NITROBENZYLSULFANYL)4PHENYL4H(124)TRIAZOL3YLMETHYL)BENZAMIDE
CC1=CC=CC(=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCC4=CC=CC=C4(N+)(=O)(O)
Cc1cccc(c1)C(=O)NCc1nnc(n1c1ccccc1)SCc1ccccc1(N+)(=O)(O)
InChI=1SC24H21N5O3Sc117871018(1417)23(30)251522262724(28(22)20113241220)3316199561321(19)29(31)32h214H1516H21H3(H2530)
MFCD08683097
ZINC000009265122
ZINC09265122
ZINC9265122
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