Vitas-M small molecule compound
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{[4-(3,4-dimethylphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STL376165
SMILES O=C(N1CCc2c(C1)cccc2)CSc1nnc(n1c1ccc(c(c1)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 C22H24N4OS MW 392.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4OS/c1-15-8-9-20(12-16(15)2)26-17(3)23-24-22(26)28-14-21(27)25-11-10-18-6-4-5-7-19(18)13-25/h4-9,12H,10-11,13-14H2,1-3H3InChIKey
MVZGFNHAYUEDHQ-UHFFFAOYSA-NSynonyms
1(34DIHYDRO1HISOQUINOLIN2YL)2((4(34DIMETHYLPHENYL)5METHYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(34dihydroisoquinolin2(1H)yl)2((4(34dimethylphenyl)5methyl4H124triazol3yl)sulfanyl)ethanone
2(34DIHYDRO2(1H)ISOQUINOLINYL)2OXOETHYL4(34DIMETHYLPHENYL)5METHYL4H124TRIAZOL3YLSULFIDE
CC1=C(C=C(C=C1)N2C(=NN=C2SCC(=O)N3CCC4=CC=CC=C4C3)C)C
InChI=1SC22H24N4OSc1158920(1216(15)2)2617(3)232422(26)281421(27)25111018645719(18)1325h4912H10111314H213H3
MFCD04328584
ZINC000000983620
ZINC00983620
ZINC983620
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