Vitas-M small molecule compound
4-hydroxy-2-oxo-N-[(2E)-4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2(3H)-ylidene]-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STL044373
SMILES O=C(c1c(=O)[nH]c2c(c1O)CCCC2)/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 C23H27N3O3S MW 425.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O3S/c27-19-15-3-1-2-4-16(15)24-20(28)18(19)21(29)26-22-25-17(11-30-22)23-8-12-5-13(9-23)7-14(6-12)10-23/h11-14H,1-10H2,(H2,24,27,28)(H,25,26,29)InChIKey
HPOIDAFQKRCTDH-UHFFFAOYSA-NSynonyms
333325-92-1333325921
4hydroxy2oxoN((2E)4(tricyclo(3311~37~)dec1yl)13thiazol2(3H)ylidene)125678hexahydroquinoline3carboxamide
C1CCC2=C(C1)C(=C(C(=O)N2)C(=O)NC3=NC(=CS3)C45CC6CC(C4)CC(C6)C5)O
InChI=1SC23H27N3O3Sc271915312416(15)2420(28)18(19)21(29)26222517(113022)23812513(923)714(612)1023h1114H110H2(H2242728)(H252629)
MFCD03811001
N(4(1adamantyl)13thiazol2yl)4hydroxy2oxo5678tetrahydro1Hquinoline3carboxamide
O=C(c1c(=O)(nH)c2c(c1O)CCCC2)N=c1scc((nH)1)C12CC3CC(C2)CC(C1)C3
ZINC000017159451
ZINC17159451
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