Vitas-M small molecule compound

(2E)-N-[5-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]-3-[4-(propan-2-yl)phenyl]prop-2-enamide

Catalog ID
STK344732
SMILES CCc1nnc2n1nc(s2)c1ccc(c(c1)NC(=O)/C=C/c1ccc(cc1)C(C)C)C

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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 C24H25N5OS MW 431.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5OS/c1-5-21-26-27-24-29(21)28-23(31-24)19-10-6-16(4)20(14-19)25-22(30)13-9-17-7-11-18(12-8-17)15(2)3/h6-15H,5H2,1-4H3,(H,25,30)/b13-9+
InChIKey
KQJSJHMRUQAOAB-UKTHLTGXSA-N
Synonyms

(2E)N(5(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)2methylphenyl)3(4(propan2yl)phenyl)prop2enamide
(2E)N(5(3ETHYL(124TRIAZOLO(34B)134THIADIAZOLIN6YL))2METHYLPHENYL)3(4(METHYLETHYL)PHENYL)PROP2ENAMIDE
(E)N(5(3ETHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)2METHYLPHENYL)3(4PROPAN2YLPHENYL)PROP2ENAMIDE
CCC1=NN=C2N1N=C(S2)C3=CC(=C(C=C3)C)NC(=O)C=CC4=CC=C(C=C4)C(C)C
CCc1nnc2n1nc(s2)c1ccc(c(c1)NC(=O)C=Cc1ccc(cc1)C(C)C)C
InChI=1SC24H25N5OSc152126272429(21)2823(3124)1910616(4)20(1419)2522(30)1391771118(12817)15(2)3h615H5H214H3(H2530)b139+
MFCD05852188
ZINC000012855488
ZINC12855488

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Available files

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