Vitas-M small molecule compound

2-{[5-(4-tert-butylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(dimethylamino)phenyl]acetamide

Catalog ID
STL050731
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1ccc(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 C25H31N5OS MW 449.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5OS/c1-7-16-30-23(18-8-10-19(11-9-18)25(2,3)4)27-28-24(30)32-17-22(31)26-20-12-14-21(15-13-20)29(5)6/h7-15H,1,16-17H2,2-6H3,(H,26,31)
InChIKey
CAZJAXJYRUJWTK-UHFFFAOYSA-N
Synonyms
805289-08-1
2((4allyl5(4(tertbutyl)phenyl)4H124triazol3yl)thio)N(4(dimethylamino)phenyl)acetamide
2((5(4tertbutylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(4(dimethylamino)phenyl)acetamide
2((5(4tertbutylphenyl)4prop2enyl124triazol3yl)sulfanyl)N(4(dimethylamino)phenyl)acetamide
2((5(4TERTBUTYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(4DIMETHYLAMINOPHENYL)ACETAMIDE
805289081
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC=C(C=C3)N(C)C
InChI=1SC25H31N5OSc17163023(1881019(11918)25(23)4)272824(30)321722(31)2620121421(151320)29(5)6h715H11617H226H3(H2631)
MFCD05683838
N(4(DIMETHYLAMINO)PHENYL)2(5(4(TERTBUTYL)PHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009307994
ZINC09307994
ZINC9307994

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Available files

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