Vitas-M small molecule compound
2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide
Catalog ID
STK197817
SMILES O=C(Nc1ccc(c(c1)[N+](=O)[O-])C)CSc1nnc(n1c1ccccc1)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 C23H19N5O3S MW 445.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5O3S/c1-16-12-13-18(14-20(16)28(30)31)24-21(29)15-32-23-26-25-22(17-8-4-2-5-9-17)27(23)19-10-6-3-7-11-19/h2-14H,15H2,1H3,(H,24,29)InChIKey
PIBJWLPNVCFKPH-UHFFFAOYSA-NSynonyms
2((45DIPHENYL124TRIAZOL3YL)SULFANYL)N(4METHYL3NITROPHENYL)ACETAMIDE
2((45DIPHENYL4H124TRIAZOL3YL)SULFANYL)N(4METHYL3NITROPHENYL)ACETAMIDE
CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4)(N+)(=O)(O)
InChI=1SC23H19N5O3Sc116121318(1420(16)28(30)31)2421(29)153223262522(178425917)27(23)19106371119h214H15H21H3(H2429)
MFCD06625759
O=C(Nc1ccc(c(c1)(N+)(=O)(O))C)CSc1nnc(n1c1ccccc1)c1ccccc1
ZINC000002875421
ZINC02875421
ZINC2875421
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