Vitas-M small molecule compound
N-(2,4-dimethoxyphenyl)-4-(2-fluorobenzyl)-3-methyl-5-oxo-2,3,4,5-tetrahydro-1,4-benzothiazepine-3-carboxamide
Catalog ID
STL439471
SMILES COc1ccc(c(c1)OC)NC(=O)C1(C)CSc2c(C(=O)N1Cc1ccccc1F)cccc2
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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 C26H25FN2O4S MW 480.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25FN2O4S/c1-26(25(31)28-21-13-12-18(32-2)14-22(21)33-3)16-34-23-11-7-5-9-19(23)24(30)29(26)15-17-8-4-6-10-20(17)27/h4-14H,15-16H2,1-3H3,(H,28,31)InChIKey
ACDKBRUPCROEAM-UHFFFAOYSA-NSynonyms
CC1(CSC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3F)C(=O)NC4=C(C=C(C=C4)OC)OC
InChI=1SC26H25FN2O4Sc126(25(31)2821131218(322)1422(21)333)1634231175919(23)24(30)29(26)15178461020(17)27h414H1516H213H3(H2831)
MFCD06245016
N(24DIMETHOXYPHENYL)4((2FLUOROPHENYL)METHYL)3METHYL5OXO2H14BENZOTHIAZEPINE3CARBOXAMIDE
N(24dimethoxyphenyl)4(2fluorobenzyl)3methyl5oxo2345tetrahydro14benzothiazepine3carboxamide
ZINC000001410569
ZINC000001410570
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