Vitas-M small molecule compound
2-{[4-(3-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethanone
Catalog ID
STL375595
SMILES Cc1cccc(c1)n1c(SCC(=O)N2CCCC2)nnc1c1ccccc1
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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 C21H22N4OS MW 378.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4OS/c1-16-8-7-11-18(14-16)25-20(17-9-3-2-4-10-17)22-23-21(25)27-15-19(26)24-12-5-6-13-24/h2-4,7-11,14H,5-6,12-13,15H2,1H3InChIKey
IRLUYPJKQBYFNZ-UHFFFAOYSA-NSynonyms
2((4(3METHYLPHENYL)5PHENYL124TRIAZOL3YL)SULFANYL)1PYRROLIDIN1YLETHANONE
2((4(3methylphenyl)5phenyl4H124triazol3yl)sulfanyl)1(pyrrolidin1yl)ethanone
CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)N3CCCC3)C4=CC=CC=C4
InChI=1SC21H22N4OSc116871118(1416)2520(1793241017)222321(25)271519(26)2412561324h2471114H56121315H21H3
MFCD03997641
ZINC000001141839
ZINC01141839
ZINC1141839
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