Vitas-M small molecule compound
2-{[4-amino-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-bromophenyl)acetamide
Catalog ID
STK151645
SMILES O=C(Nc1cccc(c1)Br)CSc1nnc(n1N)COc1ccccc1
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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 C17H16BrN5O2S MW 434.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrN5O2S/c18-12-5-4-6-13(9-12)20-16(24)11-26-17-22-21-15(23(17)19)10-25-14-7-2-1-3-8-14/h1-9H,10-11,19H2,(H,20,24)InChIKey
OMRGDHJREPIAOF-UHFFFAOYSA-NSynonyms
2((4AMINO5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)N(3BROMOPHENYL)ACETAMIDE
2((4AMINO5(PHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)N(3BROMOPHENYL)ACETAMIDE
C1=CC=C(C=C1)OCC2=NN=C(N2N)SCC(=O)NC3=CC(=CC=C3)Br
InChI=1SC17H16BrN5O2Sc181254613(912)2016(24)112617222115(23(17)19)1025147213814h19H101119H2(H2024)
MFCD06001579
ZINC000001063334
ZINC01063334
ZINC1063334
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