Vitas-M small molecule compound
2-{[5-(2-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)acetamide
Catalog ID
STL297403
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)CC)nnc1c1ccccc1Cl
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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 C21H21ClN4OS MW 412.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4OS/c1-3-13-26-20(17-7-5-6-8-18(17)22)24-25-21(26)28-14-19(27)23-16-11-9-15(4-2)10-12-16/h3,5-12H,1,4,13-14H2,2H3,(H,23,27)InChIKey
POEOCYBLHPHTRV-UHFFFAOYSA-NSynonyms
861631-16-52((4allyl5(2chlorophenyl)4H124triazol3yl)thio)N(4ethylphenyl)acetamide
2((5(2chlorophenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(4ethylphenyl)acetamide
2((5(2CHLOROPHENYL)4PROP2EN1YL4H124TRIAZOL3YL)SULFANYL)N(4ETHYLPHENYL)ACETAMIDE
2((5(2CHLOROPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(4ETHYLPHENYL)ACETAMIDE
861631165
CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=CC=C3Cl
InChI=1SC21H21ClN4OSc13132620(17756818(17)22)242521(26)281419(27)231611915(42)101216h3512H141314H22H3(H2327)
MFCD05684938
ZINC000005478500
ZINC05478500
ZINC5478500
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