Vitas-M small molecule compound
6-methyl-4-[(4-methylphenyl)sulfonyl]-N-[4-(prop-2-en-1-yloxy)phenyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Catalog ID
STL385484
SMILES C=CCOc1ccc(cc1)NC(=O)C1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)C)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 C26H26N2O5S MW 478.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O5S/c1-4-15-32-21-10-8-20(9-11-21)27-26(29)25-17-28(23-16-19(3)7-14-24(23)33-25)34(30,31)22-12-5-18(2)6-13-22/h4-14,16,25H,1,15,17H2,2-3H3,(H,27,29)InChIKey
AVLDXQTWPMCSMF-UHFFFAOYSA-NSynonyms
6methyl4((4methylphenyl)sulfonyl)N(4(prop2en1yloxy)phenyl)34dihydro2H14benzoxazine2carboxamide
6methyl4(4methylphenyl)sulfonylN(4prop2enoxyphenyl)23dihydro14benzoxazine2carboxamide
CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=C2C=C(C=C3)C)C(=O)NC4=CC=C(C=C4)OCC=C
InChI=1SC26H26N2O5Sc1415322110820(91121)2726(29)251728(231619(3)71424(23)3325)34(3031)2212518(2)61322h4141625H11517H223H3(H2729)
MFCD27217519
ZINC000064985932
ZINC000064985933
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