Vitas-M small molecule compound
3-({[2-(4-nitrophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-phenyl-5-(2-phenylethyl)-4H-1,2,4-triazole
Catalog ID
STK736287
SMILES [O-][N+](=O)c1ccc(cc1)c1scc(n1)CSc1nnc(n1c1ccccc1)CCc1ccccc1
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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 C26H21N5O2S2 MW 499.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N5O2S2/c32-31(33)23-14-12-20(13-15-23)25-27-21(17-34-25)18-35-26-29-28-24(16-11-19-7-3-1-4-8-19)30(26)22-9-5-2-6-10-22/h1-10,12-15,17H,11,16,18H2InChIKey
TZYMMVLVVUWCFT-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1)c1scc(n1)CSc1nnc(n1c1ccccc1)CCc1ccccc1
2(4nitrophenyl)4((4phenyl5(2phenylethyl)124triazol3yl)sulfanylmethyl)13thiazole
2(4NITROPHENYL)4((5PHENETHYL4PHENYL124TRIAZOL3YL)SULFANYLMETHYL)13THIAZOLE
3(((2(4nitrophenyl)13thiazol4yl)methyl)sulfanyl)4phenyl5(2phenylethyl)4H124triazole
C1=CC=C(C=C1)CCC2=NN=C(N2C3=CC=CC=C3)SCC4=CSC(=N4)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC26H21N5O2S2c3231(33)23141220(131523)252721(173425)183526292824(1611197314819)30(26)2295261022h110121517H111618H2
MFCD07022053
ZINC000012376345
ZINC12376345
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