Vitas-M small molecule compound
4-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STL174740
SMILES COc1ccc2c(c1)sc(n2)NC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCC(=O)N)C(=O)CC(C2)(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 C30H32N4O6S MW 576.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N4O6S/c1-15-25(28(37)34-29-33-18-8-7-17(38-4)11-23(18)41-29)26(27-19(32-15)12-30(2,3)13-20(27)35)16-6-9-21(22(10-16)39-5)40-14-24(31)36/h6-11,26,32H,12-14H2,1-5H3,(H2,31,36)(H,33,34,37)InChIKey
PXPFLVVYICJVGO-UHFFFAOYSA-NSynonyms
444925-79-54(4(2amino2oxoethoxy)3methoxyphenyl)N(6methoxy13benzothiazol2yl)277trimethyl5oxo145678hexahydroquinoline3carboxamide
4(4(2amino2oxoethoxy)3methoxyphenyl)N(6methoxy13benzothiazol2yl)277trimethyl5oxo1468tetrahydroquinoline3carboxamide
444925795
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)OCC(=O)N)OC)C(=O)NC4=NC5=C(S4)C=C(C=C5)OC
InChI=1SC30H32N4O6Sc11525(28(37)342933188717(384)1123(18)4129)26(2719(3215)1230(23)1320(27)35)166921(22(1016)395)401424(31)36h6112632H1214H215H3(H23136)(H333437)
MFCD03070963
ZINC000002089713
ZINC000008450298
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