Vitas-M small molecule compound
(2E)-3-(2,4-dimethoxyphenyl)-N-(5-methyl-6-oxo-5,6-dihydropyrido[2,3-b][1,4]benzothiazepin-8-yl)prop-2-enamide
Catalog ID
STL408111
SMILES COc1cc(OC)ccc1/C=C/C(=O)Nc1ccc2c(c1)C(=O)N(C)c1c(S2)nccc1
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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 C24H21N3O4S MW 447.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O4S/c1-27-19-5-4-12-25-23(19)32-21-10-8-16(13-18(21)24(27)29)26-22(28)11-7-15-6-9-17(30-2)14-20(15)31-3/h4-14H,1-3H3,(H,26,28)/b11-7+InChIKey
JKQLWSOBJZYHPE-YRNVUSSQSA-NSynonyms
1574536-96-1(2E)3(24dimethoxyphenyl)N(5methyl6oxo56dihydropyrido(23b)(14)benzothiazepin8yl)prop2enamide
(E)3(24dimethoxyphenyl)N(5methyl6oxo56dihydrobenzo(f)pyrido(23b)(14)thiazepin8yl)acrylamide
(E)3(24dimethoxyphenyl)N(5methyl6oxopyrido(23b)(14)benzothiazepin8yl)prop2enamide
1574536961
CN1C2=C(N=CC=C2)SC3=C(C1=O)C=C(C=C3)NC(=O)C=CC4=C(C=C(C=C4)OC)OC
COc1cc(OC)ccc1C=CC(=O)Nc1ccc2c(c1)C(=O)N(C)c1c(S2)nccc1
InChI=1SC24H21N3O4Sc1271954122523(19)322110816(1318(21)24(27)29)2622(28)117156917(302)1420(15)313h414H13H3(H2628)b117+
MFCD28057955
ZINC000096223318
ZINC96223318
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