Vitas-M small molecule compound

N-(5-chloro-2-methoxyphenyl)-4-(phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide

Catalog ID
STL385307
SMILES COc1ccc(cc1NC(=O)C1Oc2ccccc2N(C1)S(=O)(=O)c1ccccc1)Cl

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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 C22H19ClN2O5S MW 458.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN2O5S/c1-29-19-12-11-15(23)13-17(19)24-22(26)21-14-25(18-9-5-6-10-20(18)30-21)31(27,28)16-7-3-2-4-8-16/h2-13,21H,14H2,1H3,(H,24,26)
InChIKey
RZNYEKIDEQCTIG-UHFFFAOYSA-N
Synonyms

4(benzenesulfonyl)N(5chloro2methoxyphenyl)23dihydro14benzoxazine2carboxamide
COC1=C(C=C(C=C1)Cl)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4
InChI=1SC22H19ClN2O5Sc12919121115(23)1317(19)2422(26)211425(189561020(18)3021)31(2728)167324816h21321H14H21H3(H2426)
MFCD27217334
N(5chloro2methoxyphenyl)4(phenylsulfonyl)34dihydro2H14benzoxazine2carboxamide
ZINC000064985340
ZINC000064985342

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.