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-(3,4-dimethylphenyl)acetamide
Catalog ID
STL348122
SMILES C=CCn1c(SCC(=O)Nc2ccc(c(c2)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 C25H30N4OS MW 434.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4OS/c1-7-14-29-23(19-9-11-20(12-10-19)25(4,5)6)27-28-24(29)31-16-22(30)26-21-13-8-17(2)18(3)15-21/h7-13,15H,1,14,16H2,2-6H3,(H,26,30)InChIKey
VXFFBEAWRRNHIE-UHFFFAOYSA-NSynonyms
861644-42-02((4allyl5(4(tertbutyl)phenyl)4H124triazol3yl)thio)N(34dimethylphenyl)acetamide
2((5(4tertbutylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(34dimethylphenyl)acetamide
2((5(4TERTBUTYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(34DIMETHYLPHENYL)ACETAMIDE
861644420
CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=C(C=C3)C(C)(C)C)C
InChI=1SC25H30N4OSc17142923(1991120(121019)25(45)6)272824(29)311622(30)262113817(2)18(3)1521h71315H11416H226H3(H2630)
MFCD05686070
ZINC000009480224
ZINC09480224
ZINC9480224
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