Vitas-M small molecule compound
(5E)-3-(2-phenylethyl)-2-thioxo-5-({[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]amino}methylidene)-1,3-thiazolidin-4-one
Catalog ID
STK991783
SMILES S=C1S/C(=C/Nc2ccc(cc2)Cn2cncn2)/C(=O)N1CCc1ccccc1
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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 C21H19N5OS2 MW 421.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5OS2/c27-20-19(29-21(28)26(20)11-10-16-4-2-1-3-5-16)12-23-18-8-6-17(7-9-18)13-25-15-22-14-24-25/h1-9,12,14-15,23H,10-11,13H2/b19-12+InChIKey
NVHZCIZVPRMRBK-XDHOZWIPSA-NSynonyms
(5E)3(2phenylethyl)2sulfanylidene5((4(124triazol1ylmethyl)anilino)methylidene)13thiazolidin4one
(5E)3(2phenylethyl)2thioxo5(((4(1H124triazol1ylmethyl)phenyl)amino)methylidene)13thiazolidin4one
(Z)5(((4((1H124triazol1yl)methyl)phenyl)amino)methylene)3phenethyl2thioxothiazolidin4one
C1=CC=C(C=C1)CCN2C(=O)C(=CNC3=CC=C(C=C3)CN4C=NC=N4)SC2=S
InChI=1SC21H19N5OS2c272019(2921(28)26(20)1110164213516)1223188617(7918)13251522142425h1912141523H101113H2b1912+
MFCD13968927
S=C1SC(=CNc2ccc(cc2)Cn2cncn2)C(=O)N1CCc1ccccc1
ZINC000008993581
ZINC08993581
ZINC8993581
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