Vitas-M small molecule compound
2-[(5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-4-nitrophenyl)acetamide
Catalog ID
STK131777
SMILES O=C(Nc1ccc(cc1C)[N+](=O)[O-])CSc1nnc(n1C)Cc1ccccc1
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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 C19H19N5O3S MW 397.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O3S/c1-13-10-15(24(26)27)8-9-16(13)20-18(25)12-28-19-22-21-17(23(19)2)11-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3,(H,20,25)InChIKey
QUOVXPOSBBTDLC-UHFFFAOYSA-NSynonyms
2((5BENZYL4METHYL124TRIAZOL3YL)SULFANYL)N(2METHYL4NITROPHENYL)ACETAMIDE
2((5BENZYL4METHYL4H124TRIAZOL3YL)SULFANYL)N(2METHYL4NITROPHENYL)ACETAMIDE
CC1=C(C=CC(=C1)(N+)(=O)(O))NC(=O)CSC2=NN=C(N2C)CC3=CC=CC=C3
InChI=1SC19H19N5O3Sc1131015(24(26)27)8916(13)2018(25)122819222117(23(19)2)11146435714h310H1112H212H3(H2025)
MFCD02229799
N(2METHYL4NITROPHENYL)2(4METHYL5BENZYL(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(Nc1ccc(cc1C)(N+)(=O)(O))CSc1nnc(n1C)Cc1ccccc1
ZINC000004715505
ZINC04715505
ZINC4715505
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