Vitas-M small molecule compound

ethyl N-({[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)glycinate

Catalog ID
STL053973
SMILES CCOC(=O)CNC(=O)CSc1nnc(n1c1ccc(cc1)OCC)c1cccc(c1)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 C23H26N4O4S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O4S/c1-4-30-19-11-9-18(10-12-19)27-22(17-8-6-7-16(3)13-17)25-26-23(27)32-15-20(28)24-14-21(29)31-5-2/h6-13H,4-5,14-15H2,1-3H3,(H,24,28)
InChIKey
SBAJDGVDZPSHDC-UHFFFAOYSA-N
Synonyms
848921-50-6
848921506
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NCC(=O)OCC)C3=CC(=CC=C3)C
ETHYL2((2((4(4ETHOXYPHENYL)5(3METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)ACETATE
ETHYL2(2((4(4ETHOXYPHENYL)5(3METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)ACETATE
ethyl2(2((4(4ethoxyphenyl)5(mtolyl)4H124triazol3yl)thio)acetamido)acetate
ETHYL2(2(4(4ETHOXYPHENYL)5(3METHYLPHENYL)124TRIAZOL3YLTHIO)ACETYLAMINO)ACETATE
ethylN(((4(4ethoxyphenyl)5(3methylphenyl)4H124triazol3yl)sulfanyl)acetyl)glycinate
InChI=1SC23H26N4O4Sc14301911918(101219)2722(1786716(3)1317)252623(27)321520(28)241421(29)3152h613H451415H213H3(H2428)
MFCD05677456
ZINC000002442535
ZINC02442535
ZINC2442535

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.