Vitas-M small molecule compound

{6-methyl-4-[(4-methylphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-2-yl}(morpholin-4-yl)methanone

Catalog ID
STL385431
SMILES Cc1ccc2c(c1)N(CC(O2)C(=O)N1CCOCC1)S(=O)(=O)c1ccc(cc1)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 C21H24N2O5S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O5S/c1-15-3-6-17(7-4-15)29(25,26)23-14-20(21(24)22-9-11-27-12-10-22)28-19-8-5-16(2)13-18(19)23/h3-8,13,20H,9-12,14H2,1-2H3
InChIKey
VFGKLHIVIWABGT-UHFFFAOYSA-N
Synonyms

(6methyl4((4methylphenyl)sulfonyl)34dihydro2H14benzoxazin2yl)(morpholin4yl)methanone
(6methyl4(4methylphenyl)sulfonyl23dihydro14benzoxazin2yl)morpholin4ylmethanone
CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=C2C=C(C=C3)C)C(=O)N4CCOCC4
InChI=1SC21H24N2O5Sc1153617(7415)29(2526)231420(21(24)2291127121022)28198516(2)1318(19)23h381320H91214H212H3
MFCD27217465
ZINC000064985781
ZINC000064985782

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Available files

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