Vitas-M small molecule compound

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

Catalog ID
STK578630
SMILES CCOC(=O)CNC(=O)CSc1nnc(n1CC=C)c1ccc(cc1)F

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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 C17H19FN4O3S MW 378.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19FN4O3S/c1-3-9-22-16(12-5-7-13(18)8-6-12)20-21-17(22)26-11-14(23)19-10-15(24)25-4-2/h3,5-8H,1,4,9-11H2,2H3,(H,19,23)
InChIKey
AQSAQSHNAROVRM-UHFFFAOYSA-N
Synonyms
896078-10-7
896078107
CCOC(=O)CNC(=O)CSC1=NN=C(N1CC=C)C2=CC=C(C=C2)F
ETHYL2((2((5(4FLUOROPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)ACETATE
ethyl2(2((4allyl5(4fluorophenyl)4H124triazol3yl)thio)acetamido)acetate
ETHYL2(2((5(4FLUOROPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)ACETATE
ETHYL2(2(5(4FLUOROPHENYL)4PROP2ENYL124TRIAZOL3YLTHIO)ACETYLAMINO)ACETATE
ethylN(((5(4fluorophenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)glycinate
InChI=1SC17H19FN4O3Sc1392216(125713(18)8612)202117(22)261114(23)191015(24)2542h358H14911H22H3(H1923)
MFCD06592606
ZINC000002438817
ZINC02438817
ZINC2438817

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Available files

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