Vitas-M small molecule compound
4-[({[5-(4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Catalog ID
STL294088
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1c1ccc(cc1)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 C21H21N5O2S MW 407.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S/c1-3-12-26-20(16-6-4-14(2)5-7-16)24-25-21(26)29-13-18(27)23-17-10-8-15(9-11-17)19(22)28/h3-11H,1,12-13H2,2H3,(H2,22,28)(H,23,27)InChIKey
VROFBOXFKGWWFE-UHFFFAOYSA-NSynonyms
861639-00-14((((5(4methylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzamide
4((2((5(4METHYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZAMIDE
4(2((4allyl5(ptolyl)4H124triazol3yl)thio)acetamido)benzamide
4(2((5(4METHYLPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)BENZAMIDE
4(2(5(4METHYLPHENYL)4PROP2ENYL124TRIAZOL3YLTHIO)ACETYLAMINO)BENZAMIDE
861639001
CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC=C(C=C3)C(=O)N
InChI=1SC21H21N5O2Sc13122620(166414(2)5716)242521(26)291318(27)231710815(91117)19(22)28h311H11213H22H3(H22228)(H2327)
MFCD05685676
ZINC000005478721
ZINC05478721
ZINC5478721
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