Vitas-M small molecule compound
methyl 2,3-dioxo-1,4-diphenyl-1,2,3,5-tetrahydro-10aH-pyrrolo[2,3-b][1,5]benzothiazepine-10a-carboxylate
Catalog ID
STL445912
SMILES COC(=O)C12Sc3ccccc3NC(=C1C(=O)C(=O)N2c1ccccc1)c1ccccc1
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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 C25H18N2O4S MW 442.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N2O4S/c1-31-24(30)25-20(22(28)23(29)27(25)17-12-6-3-7-13-17)21(16-10-4-2-5-11-16)26-18-14-8-9-15-19(18)32-25/h2-15,26H,1H3InChIKey
QZUYIJVMYNAESD-UHFFFAOYSA-NSynonyms
COC(=O)C12C(=C(NC3=CC=CC=C3S1)C4=CC=CC=C4)C(=O)C(=O)N2C5=CC=CC=C5
InChI=1SC25H18N2O4Sc13124(30)2520(22(28)23(29)27(25)17126371317)21(16104251116)261814891519(18)3225h21526H1H3
methyl23dioxo14diphenyl1235tetrahydro10aHpyrrolo(23b)(15)benzothiazepine10acarboxylate
METHYL23DIOXO14DIPHENYL5HPYRROLO(23B)(15)BENZOTHIAZEPINE10ACARBOXYLATE
MFCD01113792
ZINC000003772464
ZINC000003772465
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