Vitas-M small molecule compound

methyl 4-[4-(dimethylamino)phenyl]-4H-1,4-benzothiazine-2-carboxylate 1,1-dioxide

Catalog ID
STL096028
SMILES COC(=O)C1=CN(c2ccc(cc2)N(C)C)c2c(S1(=O)=O)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 C18H18N2O4S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S/c1-19(2)13-8-10-14(11-9-13)20-12-17(18(21)24-3)25(22,23)16-7-5-4-6-15(16)20/h4-12H,1-3H3
InChIKey
CQTFLSIYDQUZBV-UHFFFAOYSA-N
Synonyms
1291839-65-0
1291839650
CN(C)C1=CC=C(C=C1)N2C=C(S(=O)(=O)C3=CC=CC=C32)C(=O)OC
InChI=1SC18H18N2O4Sc119(2)1381014(11913)201217(18(21)243)25(2223)16754615(16)20h412H13H3
methyl4(4(dimethylamino)phenyl)11dioxo1$l^(6)4benzothiazine2carboxylate
methyl4(4(dimethylamino)phenyl)4H14benzothiazine2carboxylate11dioxide
METHYL4(4(DIMETHYLAMINO)PHENYL)4HBENZO(B)(14)THIAZINE2CARBOXYLATE11DIOXIDE
MFCD18788305
ZINC000064979150
ZINC64979150

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Available files

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