Vitas-M small molecule compound
4-benzyl-N-[4-(dimethylamino)phenyl]-3-methyl-5-oxo-2,3,4,5-tetrahydro-1,4-benzothiazepine-3-carboxamide
Catalog ID
STL439468
SMILES CN(c1ccc(cc1)NC(=O)C1(C)CSc2c(C(=O)N1Cc1ccccc1)cccc2)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 C26H27N3O2S MW 445.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O2S/c1-26(25(31)27-20-13-15-21(16-14-20)28(2)3)18-32-23-12-8-7-11-22(23)24(30)29(26)17-19-9-5-4-6-10-19/h4-16H,17-18H2,1-3H3,(H,27,31)InChIKey
DFVRNHWXBKEGLK-UHFFFAOYSA-NSynonyms
4benzylN(4(dimethylamino)phenyl)3methyl5oxo2345tetrahydro14benzothiazepine3carboxamide
4benzylN(4(dimethylamino)phenyl)3methyl5oxo2H14benzothiazepine3carboxamide
4BENZYLN(4DIMETHYLAMINOPHENYL)3METHYL5OXO2H14BENZOTHIAZEPINE3CARBOXAMIDE
CC1(CSC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)N(C)C
InChI=1SC26H27N3O2Sc126(25(31)2720131521(161420)28(2)3)18322312871122(23)24(30)29(26)171995461019h416H1718H213H3(H2731)
MFCD06245024
ZINC000001410585
ZINC000001410586
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