Vitas-M small molecule compound
2-methyl-1-oxo-N-[(2E)-5-(tetrahydrofuran-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-1,2-dihydroisoquinoline-4-carboxamide
Catalog ID
STL153768
SMILES O=C(c1cn(C)c(=O)c2c1cccc2)/N=c/1\[nH]nc(s1)C1CCCO1
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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 C17H16N4O3S MW 356.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O3S/c1-21-9-12(10-5-2-3-6-11(10)16(21)23)14(22)18-17-20-19-15(25-17)13-7-4-8-24-13/h2-3,5-6,9,13H,4,7-8H2,1H3,(H,18,20,22)InChIKey
QGEVAJLZZJNYOK-UHFFFAOYSA-NSynonyms
1282142-09-91282142099
2methyl1oxoN((2E)5(tetrahydrofuran2yl)134thiadiazol2(3H)ylidene)12dihydroisoquinoline4carboxamide
2methyl1oxoN(5(oxolan2yl)134thiadiazol2yl)isoquinoline4carboxamide
CN1C=C(C2=CC=CC=C2C1=O)C(=O)NC3=NN=C(S3)C4CCCO4
InChI=1SC17H16N4O3Sc121912(10523611(10)16(21)23)14(22)1817201915(2517)137482413h2356913H478H21H3(H182022)
MFCD20756774
O=C(c1cn(C)c(=O)c2c1cccc2)N=c1(nH)nc(s1)C1CCCO1
ZINC000061719714
ZINC000061719715
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