Vitas-M small molecule compound
N-(2-methyl-5-nitrophenyl)-2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK323817
SMILES O=C(Nc1cc(ccc1C)[N+](=O)[O-])CSc1nnc(n1c1ccccc1)c1cccs1
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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 C21H17N5O3S2 MW 451.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O3S2/c1-14-9-10-16(26(28)29)12-17(14)22-19(27)13-31-21-24-23-20(18-8-5-11-30-18)25(21)15-6-3-2-4-7-15/h2-12H,13H2,1H3,(H,22,27)InChIKey
QNTZHWVOGCVCQX-UHFFFAOYSA-NSynonyms
889949-31-9889949319
CC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CS4
InChI=1SC21H17N5O3S2c11491016(26(28)29)1217(14)2219(27)133121242320(1885113018)25(21)156324715h212H13H21H3(H2227)
MFCD06617320
N(2methyl5nitrophenyl)2((4phenyl5(thiophen2yl)4H124triazol3yl)sulfanyl)acetamide
N(2METHYL5NITROPHENYL)2((4PHENYL5THIOPHEN2YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
O=C(Nc1cc(ccc1C)(N+)(=O)(O))CSc1nnc(n1c1ccccc1)c1cccs1
ZINC000010178215
ZINC10178215
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