Vitas-M small molecule compound
7-hydroxy-5-oxo-N-[(2E)-4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2(3H)-ylidene]-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-6-carboxamide
Catalog ID
STL047602
SMILES O=C(c1c(O)c2cccc3c2n(c1=O)CCC3)/N=c\1/scc([nH]1)C12CC3CC(C2)CC(C1)C3
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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 C26H27N3O3S MW 461.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3S/c30-22-18-5-1-3-17-4-2-6-29(21(17)18)24(32)20(22)23(31)28-25-27-19(13-33-25)26-10-14-7-15(11-26)9-16(8-14)12-26/h1,3,5,13-16,30H,2,4,6-12H2,(H,27,28,31)InChIKey
ZEQNJNGSPYVWSJ-UHFFFAOYSA-NSynonyms
7hydroxy5oxoN((2E)4(tricyclo(3311~37~)dec1yl)13thiazol2(3H)ylidene)23dihydro1H5Hpyrido(321ij)quinoline6carboxamide
C1CC2=CC=CC3=C2N(C1)C(=O)C(=C3O)C(=O)NC4=NC(=CS4)C56CC7CC(C5)CC(C7)C6
InChI=1SC26H27N3O3Sc3022185131742629(21(17)18)24(32)20(22)23(31)28252719(133325)261014715(1126)916(814)1226h135131630H24612H2(H272831)
MFCD03803811
O=C(c1c(O)c2cccc3c2n(c1=O)CCC3)N=c1scc((nH)1)C12CC3CC(C2)CC(C1)C3
ZINC000100662865
ZINC100662865
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