Vitas-M small molecule compound
2-{[5-benzyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-bromophenyl)acetamide
Catalog ID
STK245467
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)Br)nnc1Cc1ccccc1
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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 C20H19BrN4OS MW 443.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrN4OS/c1-2-12-25-18(13-15-6-4-3-5-7-15)23-24-20(25)27-14-19(26)22-17-10-8-16(21)9-11-17/h2-11H,1,12-14H2,(H,22,26)InChIKey
SQTVVILMPWUKMX-UHFFFAOYSA-NSynonyms
2((5BENZYL4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)N(4BROMOPHENYL)ACETAMIDE
2((5BENZYL4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(4BROMOPHENYL)ACETAMIDE
2(4ALLYL5BENZYL4H(124)TRIAZOL3YLSULFANYL)N(4BROMOPHENYL)ACETAMIDE
C=CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Br)CC3=CC=CC=C3
InChI=1SC20H19BrN4OSc12122518(13156435715)232420(25)271419(26)221710816(21)91117h211H11214H2(H2226)
MFCD06116782
ZINC000009306077
ZINC09306077
ZINC9306077
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